3-cyclohexyl-1-(pyridin-4-ylmethyl)urea

3-cyclohexyl-1-(pyridin-4-ylmethyl)urea

CAS: 131519-56-7

Formula: C13H19N3O

SMILES: O=C(NCC1=CC=NC=C1)NC1CCCCC1

IUPAC: 3-cyclohexyl-1-[(pyridin-4-yl)methyl]urea

InChI: InChI=1S/C13H19N3O/c17-13(16-12-4-2-1-3-5-12)15-10-11-6-8-14-9-7-11/h6-9,12H,1-5,10H2,(H2,15,16,17)

Composition: C (66.92%), H (8.21%), N (18.01%), O (6.86%)

Molar Mass: 233.315

Atom Count: 36

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	233.152812244
Formal Charge	0
FSP3	0.54
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
InChIKey	GRFSYZCLGWVEOX-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	66.41
Topological Polar Surface Area	54.02
Polarizability	25.77
Ring Count	2
Rotatable Bond Count	3

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90%	<2 Days	131519-56-7		$51.35-$524.40$51.35$63.37$86.31$524.40