3-[[2-(2-chlorophenyl)cyclopropanecarbonyl]amino]benzamide

C17H15ClN2O2 — CID 51295099

IUPAC3-[[2-(2-chlorophenyl)cyclopropanecarbonyl]amino]benzamide
SMILESNC(=O)c1cccc(NC(=O)C2CC2c2ccccc2Cl)c1
InChIInChI=1S/C17H15ClN2O2/c18-15-7-2-1-6-12(15)13-9-14(13)17(22)20-11-5-3-4-10(8-11)16(19)21/h1-8,13-14H,9H2,(H2,19,21)(H,20,22)
InChIKeyDRHQJXWMPZWWOR-UHFFFAOYSA-N
MW314.77 g/mol
LogP3.18
Rot. Bonds4

About 3-[[2-(2-chlorophenyl)cyclopropanecarbonyl]amino]benzamide

3-[[2-(2-chlorophenyl)cyclopropanecarbonyl]amino]benzamide (PubChem CID 51295099) has the molecular formula C17H15ClN2O2 and a molecular weight of 314.77 g/mol. Its IUPAC name is 3-[[2-(2-chlorophenyl)cyclopropanecarbonyl]amino]benzamide.

Molecular Properties

Compound Name3-[[2-(2-chlorophenyl)cyclopropanecarbonyl]amino]benzamide
PubChem CID51295099
Molecular FormulaC17H15ClN2O2
Molecular Weight314.77 g/mol
Exact Mass314.08
IUPAC Name3-[[2-(2-chlorophenyl)cyclopropanecarbonyl]amino]benzamide
SMILESNC(=O)c1cccc(NC(=O)C2CC2c2ccccc2Cl)c1
InChIInChI=1S/C17H15ClN2O2/c18-15-7-2-1-6-12(15)13-9-14(13)17(22)20-11-5-3-4-10(8-11)16(19)21/h1-8,13-14H,9H2,(H2,19,21)(H,20,22)
InChIKeyDRHQJXWMPZWWOR-UHFFFAOYSA-N
XLogP3.18
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.77
LogP ≤ 53.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-[[2-(2-chlorophenyl)cyclopropanecarbonyl]amino]-N-cyclopropylbenzamide
CID 51295410
2-chloro-4-[[(1R,2R)-2-(2-chlorophenyl)cyclopropanecarbonyl]amino]benzamide
CID 95311713
3-[[2-(2,3-difluorophenyl)cyclopropanecarbonyl]amino]benzamide
CID 139003868
2-(2-chlorophenyl)-N-[3-(1-methyltetrazol-5-yl)phenyl]cyclopropane-1-carboxamide
CID 51317920
cis-(1R,2S)-N-(4-acetamido-3-methoxyphenyl)-2-(2-chlorophenyl)cyclopropane-1-carboxamide
CID 52528491
3-[[2-(3-methylthiophen-2-yl)cyclopropanecarbonyl]amino]benzamide
CID 139011850
2-(2-chlorophenyl)-N-[2-methyl-5-(phenylcarbamoylamino)phenyl]cyclopropane-1-carboxamide
CID 55763153
4-[[2-(2-chlorophenyl)cyclopropanecarbonyl]amino]-N,N-diethylbenzamide
CID 51295036
N-(2-chloro-4-fluorophenyl)-2-(2-chlorophenyl)cyclopropane-1-carboxamide
CID 55476894
2-(2-chlorophenyl)-N-(4-propan-2-yloxyphenyl)cyclopropane-1-carboxamide
CID 55748842
N-[3-[[[2-(2-chlorophenyl)cyclopropanecarbonyl]amino]methyl]phenyl]-4-methylbenzamide
CID 55898897
2-[(3-carbamoylphenyl)carbamoyl]cyclopentane-1-carboxylic acid
CID 103977967

Frequently Asked Questions

What is the IUPAC name of 3-[[2-(2-chlorophenyl)cyclopropanecarbonyl]amino]benzamide?
The IUPAC name of 3-[[2-(2-chlorophenyl)cyclopropanecarbonyl]amino]benzamide (CID 51295099) is 3-[[2-(2-chlorophenyl)cyclopropanecarbonyl]amino]benzamide.
What is the SMILES notation for 3-[[2-(2-chlorophenyl)cyclopropanecarbonyl]amino]benzamide?
The canonical SMILES for 3-[[2-(2-chlorophenyl)cyclopropanecarbonyl]amino]benzamide is NC(=O)c1cccc(NC(=O)C2CC2c2ccccc2Cl)c1.
What is the InChIKey of 3-[[2-(2-chlorophenyl)cyclopropanecarbonyl]amino]benzamide?
The InChIKey is DRHQJXWMPZWWOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15ClN2O2/c18-15-7-2-1-6-12(15)13-9-14(13)17(22)20-11-5-3-4-10(8-11)16(19)21/h1-8,13-14H,9H2,(H2,19,21)(H,20,22).
What are the key properties of 3-[[2-(2-chlorophenyl)cyclopropanecarbonyl]amino]benzamide?
3-[[2-(2-chlorophenyl)cyclopropanecarbonyl]amino]benzamide has a molecular weight of 314.77 g/mol, XLogP of 3.18, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[2-(2-chlorophenyl)cyclopropanecarbonyl]amino]benzamide is sourced from PubChem (CID 51295099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).