1-acetyl-N-benzylcyclopropane-1-carboxamide

1-acetyl-N-benzylcyclopropane-1-carboxamide

CAS: 147011-39-0

Formula: C13H15NO2

SMILES: CC(=O)C1(CC1)C(=O)NCC1=CC=CC=C1

IUPAC: 1-acetyl-N-benzylcyclopropane-1-carboxamide

InChI: InChI=1S/C13H15NO2/c1-10(15)13(7-8-13)12(16)14-9-11-5-3-2-4-6-11/h2-6H,7-9H2,1H3,(H,14,16)

Composition: C (71.87%), H (6.96%), N (6.45%), O (14.73%)

Molar Mass: 217.268

Atom Count: 31

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	217.110278727
Formal Charge	0
FSP3	0.38
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	LPBGWBQVWDCUHX-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	61.14
Topological Polar Surface Area	46.17
Polarizability	23.77
Ring Count	2
Rotatable Bond Count	4

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