1,2,3,4-tetrahydroisoquinoline-3-carboxamide

1,2,3,4-tetrahydroisoquinoline-3-carboxamide

CAS: 112794-29-3

Formula: C10H12N2O

SMILES: NC(=O)C1CC2=CC=CC=C2CN1

IUPAC: 1,2,3,4-tetrahydroisoquinoline-3-carboxamide

InChI: InChI=1/C10H12N2O/c11-10(13)9-5-7-3-1-2-4-8(7)6-12-9/h1-4,9,12H,5-6H2,(H2,11,13)

Composition: C (68.16%), H (6.86%), N (15.90%), O (9.08%)

Molar Mass: 176.219

Atom Count: 25

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	1
Exact Mass	176.094963014
Formal Charge	0
FSP3	0.3
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
InChIKey	JFMNKDRNEZZRBW-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	50.27
Topological Polar Surface Area	55.12
Polarizability	19.69
Ring Count	2
Rotatable Bond Count	1

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