N-(pyridin-4-ylmethyl)cyclopropanamine dihydrochloride

N-(pyridin-4-ylmethyl)cyclopropanamine dihydrochloride

CAS: 1609403-18-0

Formula: C9H14Cl2N2

SMILES: Cl.Cl.C(NC1CC1)C1=CC=NC=C1

IUPAC: N-[(pyridin-4-yl)methyl]cyclopropanamine dihydrochloride

InChI: InChI=1S/C9H12N2.2ClH/c1-2-9(1)11-7-8-3-5-10-6-4-8;;/h3-6,9,11H,1-2,7H2;2*1H

Composition: C (48.89%), H (6.38%), Cl (32.06%), N (12.67%)

Molar Mass: 221.13

Atom Count: 27

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	220.0534039
Formal Charge	0
FSP3	0.44
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	FETFJKSMCFPDKP-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	44.36
Topological Polar Surface Area	24.92
Polarizability	17.6
Ring Count	2
Rotatable Bond Count	3

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