methyl 6-(aminomethyl)pyridine-3-carboxylate

methyl 6-(aminomethyl)pyridine-3-carboxylate

CAS: 139183-87-2

Formula: C8H10N2O2

SMILES: COC(=O)C1=CC=C(CN)N=C1

IUPAC: methyl 6-(aminomethyl)pyridine-3-carboxylate

InChI: InChI=1S/C8H10N2O2/c1-12-8(11)6-2-3-7(4-9)10-5-6/h2-3,5H,4,9H2,1H3

Composition: C (57.82%), H (6.07%), N (16.86%), O (19.26%)

Molar Mass: 166.18

Atom Count: 22

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	166.07422757
Formal Charge	0
FSP3	0.25
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	WGPAOTBWPMCFMM-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	43.88
Topological Polar Surface Area	65.21
Polarizability	17.23
Ring Count	1
Rotatable Bond Count	3

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