2-chloro-N-[(1-phenylcyclopentyl)methyl]benzamide

C19H20ClNO — CID 847347

IUPAC2-chloro-N-[(1-phenylcyclopentyl)methyl]benzamide
SMILESO=C(NCC1(c2ccccc2)CCCC1)c1ccccc1Cl
InChIInChI=1S/C19H20ClNO/c20-17-11-5-4-10-16(17)18(22)21-14-19(12-6-7-13-19)15-8-2-1-3-9-15/h1-5,8-11H,6-7,12-14H2,(H,21,22)
InChIKeyGJZJPATXQWTERB-UHFFFAOYSA-N
MW313.83 g/mol
LogP4.58
Rot. Bonds4

About 2-chloro-N-[(1-phenylcyclopentyl)methyl]benzamide

2-chloro-N-[(1-phenylcyclopentyl)methyl]benzamide (PubChem CID 847347) has the molecular formula C19H20ClNO and a molecular weight of 313.83 g/mol. Its IUPAC name is 2-chloro-N-[(1-phenylcyclopentyl)methyl]benzamide.

Molecular Properties

Compound Name2-chloro-N-[(1-phenylcyclopentyl)methyl]benzamide
PubChem CID847347
Molecular FormulaC19H20ClNO
Molecular Weight313.83 g/mol
Exact Mass313.12
IUPAC Name2-chloro-N-[(1-phenylcyclopentyl)methyl]benzamide
SMILESO=C(NCC1(c2ccccc2)CCCC1)c1ccccc1Cl
InChIInChI=1S/C19H20ClNO/c20-17-11-5-4-10-16(17)18(22)21-14-19(12-6-7-13-19)15-8-2-1-3-9-15/h1-5,8-11H,6-7,12-14H2,(H,21,22)
InChIKeyGJZJPATXQWTERB-UHFFFAOYSA-N
XLogP4.58
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.83
LogP ≤ 54.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2,4-dichloro-N-[(4-phenyloxan-4-yl)methyl]benzamide
CID 1082222
2-morpholin-4-yl-N-[(1-phenylcyclopentyl)methyl]benzamide
CID 77085484
4-fluoro-N-[(1-phenylcyclopentyl)methyl]benzamide
CID 737856
2,5-dichloro-N-[(4-phenyloxan-4-yl)methyl]benzamide
CID 27448808
methyl 2-[2-[(1-phenylcyclopentyl)methylcarbamoyl]phenyl]sulfanylpropanoate
CID 55871591
N-[[1-(4-chlorophenyl)cyclopropyl]methyl]-2-fluorobenzamide
CID 42265696
1-(2-amino-2-oxoethyl)-2-oxo-N-[(1-phenylcyclopentyl)methyl]pyridine-3-carboxamide
CID 92635144
2-(2-chloro-6-fluorophenyl)-N-[(1-phenylcyclobutyl)methyl]acetamide
CID 18139443
N-[(1-phenylcyclopentyl)methyl]cyclohexanecarboxamide
CID 18128273
4-amino-N-[(1-phenylcyclobutyl)methyl]benzamide
CID 110462616
2-bromo-N-[(4-phenyloxan-4-yl)methyl]benzamide
CID 1340930
4-chloro-5-fluoro-N-[(1-phenylcyclopropyl)methyl]pyridine-3-carboxamide
CID 126828456

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[(1-phenylcyclopentyl)methyl]benzamide?
The IUPAC name of 2-chloro-N-[(1-phenylcyclopentyl)methyl]benzamide (CID 847347) is 2-chloro-N-[(1-phenylcyclopentyl)methyl]benzamide.
What is the SMILES notation for 2-chloro-N-[(1-phenylcyclopentyl)methyl]benzamide?
The canonical SMILES for 2-chloro-N-[(1-phenylcyclopentyl)methyl]benzamide is O=C(NCC1(c2ccccc2)CCCC1)c1ccccc1Cl.
What is the InChIKey of 2-chloro-N-[(1-phenylcyclopentyl)methyl]benzamide?
The InChIKey is GJZJPATXQWTERB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20ClNO/c20-17-11-5-4-10-16(17)18(22)21-14-19(12-6-7-13-19)15-8-2-1-3-9-15/h1-5,8-11H,6-7,12-14H2,(H,21,22).
What are the key properties of 2-chloro-N-[(1-phenylcyclopentyl)methyl]benzamide?
2-chloro-N-[(1-phenylcyclopentyl)methyl]benzamide has a molecular weight of 313.83 g/mol, XLogP of 4.58, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-[(1-phenylcyclopentyl)methyl]benzamide is sourced from PubChem (CID 847347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).