3-(dimethylamino)-2-(4-methylpiperazine-1-carbonyl)prop-2-enenitrile

3-(dimethylamino)-2-(4-methylpiperazine-1-carbonyl)prop-2-enenitrile

CAS: 551930-69-9

Formula: C11H18N4O

SMILES: CN(C)C=C(C#N)C(=O)N1CCN(C)CC1

IUPAC: 3-(dimethylamino)-2-(4-methylpiperazine-1-carbonyl)prop-2-enenitrile

InChI: InChI=1S/C11H18N4O/c1-13(2)9-10(8-12)11(16)15-6-4-14(3)5-7-15/h9H,4-7H2,1-3H3

Composition: C (59.44%), H (8.16%), N (25.20%), O (7.20%)

Molar Mass: 222.292

Atom Count: 34

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	222.148061216
Formal Charge	0
FSP3	0.64
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	QSZQWHUEPNEXSL-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	63.72
Topological Polar Surface Area	50.58
Polarizability	23.74
Ring Count	1
Rotatable Bond Count	2

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Purity	LeadTime	CAS	PacketSize	UnitPrice
90%	<2 Days	551930-69-9		$51.35-$86.31$51.35$63.37$86.31