N-[(4-chlorophenyl)-cyclopropylmethyl]benzamide

C17H16ClNO — CID 17494418

IUPACN-[(4-chlorophenyl)-cyclopropylmethyl]benzamide
SMILESO=C(NC(c1ccc(Cl)cc1)C1CC1)c1ccccc1
InChIInChI=1S/C17H16ClNO/c18-15-10-8-13(9-11-15)16(12-6-7-12)19-17(20)14-4-2-1-3-5-14/h1-5,8-12,16H,6-7H2,(H,19,20)
InChIKeyZEQXTGMQSBPHJP-UHFFFAOYSA-N
MW285.77 g/mol
LogP4.22
Rot. Bonds4

About N-[(4-chlorophenyl)-cyclopropylmethyl]benzamide

N-[(4-chlorophenyl)-cyclopropylmethyl]benzamide (PubChem CID 17494418) has the molecular formula C17H16ClNO and a molecular weight of 285.77 g/mol. Its IUPAC name is N-[(4-chlorophenyl)-cyclopropylmethyl]benzamide.

Molecular Properties

Compound NameN-[(4-chlorophenyl)-cyclopropylmethyl]benzamide
PubChem CID17494418
Molecular FormulaC17H16ClNO
Molecular Weight285.77 g/mol
Exact Mass285.09
IUPAC NameN-[(4-chlorophenyl)-cyclopropylmethyl]benzamide
SMILESO=C(NC(c1ccc(Cl)cc1)C1CC1)c1ccccc1
InChIInChI=1S/C17H16ClNO/c18-15-10-8-13(9-11-15)16(12-6-7-12)19-17(20)14-4-2-1-3-5-14/h1-5,8-12,16H,6-7H2,(H,19,20)
InChIKeyZEQXTGMQSBPHJP-UHFFFAOYSA-N
XLogP4.22
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.77
LogP ≤ 54.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[4-[[(4-chlorophenyl)-cyclopropylmethyl]amino]-4-oxobutyl]benzamide
CID 51187247
N-[cyclopropyl-(4-methoxyphenyl)methyl]benzamide
CID 46566275
N-[(R)-(4-chlorophenyl)-cyclopropylmethyl]-2H-benzotriazole-5-carboxamide
CID 41198922
N-[(R)-(4-chlorophenyl)-cyclopropylmethyl]furan-2-carboxamide
CID 40919026
5-bromo-N-[(S)-(4-chlorophenyl)-cyclopropylmethyl]pyridine-3-carboxamide
CID 41155829
4-(bromomethyl)-N-[cyclopropyl(phenyl)methyl]benzamide
CID 102850932
3-bromo-2-chloro-N-[cyclopropyl(phenyl)methyl]benzamide
CID 103982987
3-chloro-N-[(4-chlorophenyl)-cyclopropylmethyl]-4,5-dimethoxybenzamide
CID 45353412
1-benzyl-3-[(S)-(4-chlorophenyl)-cyclopropylmethyl]-1-methylurea
CID 41200260
N-[cyclopropyl(phenyl)methyl]-2-methylbenzamide
CID 51295877
4-(benzenesulfonyl)-N-[(S)-(4-chlorophenyl)-cyclopropylmethyl]piperazine-1-carboxamide
CID 41200236
N-[4-[[cyclopropyl-(4-methylphenyl)methyl]amino]-4-oxobutan-2-yl]benzamide
CID 24625904

Frequently Asked Questions

What is the IUPAC name of N-[(4-chlorophenyl)-cyclopropylmethyl]benzamide?
The IUPAC name of N-[(4-chlorophenyl)-cyclopropylmethyl]benzamide (CID 17494418) is N-[(4-chlorophenyl)-cyclopropylmethyl]benzamide.
What is the SMILES notation for N-[(4-chlorophenyl)-cyclopropylmethyl]benzamide?
The canonical SMILES for N-[(4-chlorophenyl)-cyclopropylmethyl]benzamide is O=C(NC(c1ccc(Cl)cc1)C1CC1)c1ccccc1.
What is the InChIKey of N-[(4-chlorophenyl)-cyclopropylmethyl]benzamide?
The InChIKey is ZEQXTGMQSBPHJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16ClNO/c18-15-10-8-13(9-11-15)16(12-6-7-12)19-17(20)14-4-2-1-3-5-14/h1-5,8-12,16H,6-7H2,(H,19,20).
What are the key properties of N-[(4-chlorophenyl)-cyclopropylmethyl]benzamide?
N-[(4-chlorophenyl)-cyclopropylmethyl]benzamide has a molecular weight of 285.77 g/mol, XLogP of 4.22, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-chlorophenyl)-cyclopropylmethyl]benzamide is sourced from PubChem (CID 17494418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).