5-chloro-N-cyclopropyl-2-(methylamino)benzamide

C11H13ClN2O — CID 62171127

IUPAC5-chloro-N-cyclopropyl-2-(methylamino)benzamide
SMILESCNc1ccc(Cl)cc1C(=O)NC1CC1
InChIInChI=1S/C11H13ClN2O/c1-13-10-5-2-7(12)6-9(10)11(15)14-8-3-4-8/h2,5-6,8,13H,3-4H2,1H3,(H,14,15)
InChIKeyRBDCFVHHLFPHHN-UHFFFAOYSA-N
MW224.69 g/mol
LogP2.27
Rot. Bonds3

About 5-chloro-N-cyclopropyl-2-(methylamino)benzamide

5-chloro-N-cyclopropyl-2-(methylamino)benzamide (PubChem CID 62171127) has the molecular formula C11H13ClN2O and a molecular weight of 224.69 g/mol. Its IUPAC name is 5-chloro-N-cyclopropyl-2-(methylamino)benzamide.

Molecular Properties

Compound Name5-chloro-N-cyclopropyl-2-(methylamino)benzamide
PubChem CID62171127
Molecular FormulaC11H13ClN2O
Molecular Weight224.69 g/mol
Exact Mass224.07
IUPAC Name5-chloro-N-cyclopropyl-2-(methylamino)benzamide
SMILESCNc1ccc(Cl)cc1C(=O)NC1CC1
InChIInChI=1S/C11H13ClN2O/c1-13-10-5-2-7(12)6-9(10)11(15)14-8-3-4-8/h2,5-6,8,13H,3-4H2,1H3,(H,14,15)
InChIKeyRBDCFVHHLFPHHN-UHFFFAOYSA-N
XLogP2.27
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.69
LogP ≤ 52.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

5-chloro-2-(methylamino)-N-(oxan-4-yl)benzamide
CID 55046977
5-chloro-N-(1,1-dioxothiolan-3-yl)-2-(methylamino)benzamide
CID 55042392
5-chloro-N-[4-(cyclopropylamino)-4-oxobutyl]-2-(methylamino)benzamide
CID 79382058
5-chloro-N-(1,1-dioxothian-3-yl)-2-(methylamino)benzamide
CID 63917316
2,5-dichloro-N-[4-[(2,5-dichlorobenzoyl)amino]cyclohexyl]benzamide
CID 2165949
5-chloro-N-(2,2-dimethylcyclopropyl)-2-(methylamino)benzamide
CID 55047042
5-chloro-N-cyclohexyl-2-hydrazinylbenzamide
CID 62237687
5-chloro-N-cyclopropyl-2-methylbenzamide;5-chloro-2-methylbenzoic acid
CID 159378418
5-methyl-2-(methylamino)-N-(4-methylcyclohexyl)benzamide
CID 55083319
5-chloro-N-cyclohexyl-2-methylbenzamide
CID 83407385
5-chloro-N-(1,1-dioxothian-4-yl)-2-hydrazinylbenzamide
CID 62237430
5-chloro-N-(1-cyclohexylpropyl)-2-(methylamino)benzamide
CID 63499195

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-cyclopropyl-2-(methylamino)benzamide?
The IUPAC name of 5-chloro-N-cyclopropyl-2-(methylamino)benzamide (CID 62171127) is 5-chloro-N-cyclopropyl-2-(methylamino)benzamide.
What is the SMILES notation for 5-chloro-N-cyclopropyl-2-(methylamino)benzamide?
The canonical SMILES for 5-chloro-N-cyclopropyl-2-(methylamino)benzamide is CNc1ccc(Cl)cc1C(=O)NC1CC1.
What is the InChIKey of 5-chloro-N-cyclopropyl-2-(methylamino)benzamide?
The InChIKey is RBDCFVHHLFPHHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13ClN2O/c1-13-10-5-2-7(12)6-9(10)11(15)14-8-3-4-8/h2,5-6,8,13H,3-4H2,1H3,(H,14,15).
What are the key properties of 5-chloro-N-cyclopropyl-2-(methylamino)benzamide?
5-chloro-N-cyclopropyl-2-(methylamino)benzamide has a molecular weight of 224.69 g/mol, XLogP of 2.27, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-cyclopropyl-2-(methylamino)benzamide is sourced from PubChem (CID 62171127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).