1-(4-methylcyclohexyl)-4-[(3-nitrophenyl)methyl]piperazine

1-(4-methylcyclohexyl)-4-[(3-nitrophenyl)methyl]piperazine

Formula: C18H27N3O2

SMILES: CC1CCC(CC1)N1CCN(CC2=CC=CC(=C2)[N+]([O-])=O)CC1

IUPAC: 1-(4-methylcyclohexyl)-4-[(3-nitrophenyl)methyl]piperazine

InChI: InChI=1S/C18H27N3O2/c1-15-5-7-17(8-6-15)20-11-9-19(10-12-20)14-16-3-2-4-18(13-16)21(22)23/h2-4,13,15,17H,5-12,14H2,1H3

Composition: C (68.11%), H (8.57%), N (13.24%), O (10.08%)

Molar Mass: 317.433

Atom Count: 50

Heavy Atom Count: 23

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	317.210327121
Formal Charge	0
FSP3	0.67
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	WIGYKFDFEQOAPR-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	92.53
Topological Polar Surface Area	49.62
Polarizability	35.87
Ring Count	3
Rotatable Bond Count	4

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C18H27N3O2		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00