4-(3-chloro-2-pyridinyl)-N-cyclopropylbenzamide

C15H13ClN2O — CID 59673165

IUPAC4-(3-chloro-2-pyridinyl)-N-cyclopropylbenzamide
SMILESO=C(NC1CC1)c1ccc(-c2ncccc2Cl)cc1
InChIInChI=1S/C15H13ClN2O/c16-13-2-1-9-17-14(13)10-3-5-11(6-4-10)15(19)18-12-7-8-12/h1-6,9,12H,7-8H2,(H,18,19)
InChIKeyRFTVIIVCZNJAQP-UHFFFAOYSA-N
MW272.74 g/mol
LogP3.29
Rot. Bonds3

About 4-(3-chloro-2-pyridinyl)-N-cyclopropylbenzamide

4-(3-chloro-2-pyridinyl)-N-cyclopropylbenzamide (PubChem CID 59673165) has the molecular formula C15H13ClN2O and a molecular weight of 272.74 g/mol. Its IUPAC name is 4-(3-chloro-2-pyridinyl)-N-cyclopropylbenzamide.

Molecular Properties

Compound Name4-(3-chloro-2-pyridinyl)-N-cyclopropylbenzamide
PubChem CID59673165
Molecular FormulaC15H13ClN2O
Molecular Weight272.74 g/mol
Exact Mass272.07
IUPAC Name4-(3-chloro-2-pyridinyl)-N-cyclopropylbenzamide
SMILESO=C(NC1CC1)c1ccc(-c2ncccc2Cl)cc1
InChIInChI=1S/C15H13ClN2O/c16-13-2-1-9-17-14(13)10-3-5-11(6-4-10)15(19)18-12-7-8-12/h1-6,9,12H,7-8H2,(H,18,19)
InChIKeyRFTVIIVCZNJAQP-UHFFFAOYSA-N
XLogP3.29
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.74
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-(3-chloro-2-pyridinyl)-N-cyclopropyl-3-fluorobenzamide
CID 59672610
4-(3-chloro-2-pyridinyl)-N-ethylbenzamide
CID 59673494
4-(3-chloro-2-pyridinyl)-N-(4-phenylphenyl)benzamide
CID 11234504
N-[4-(pyridine-2-carbonylamino)cyclohexyl]pyridine-2-carboxamide
CID 167956409
N-[4-(azepan-1-yl)phenyl]-4-(3-chloro-2-pyridinyl)benzamide
CID 11153979
4-(3-methoxy-2-pyridinyl)-N-[(3S)-oxolan-3-yl]benzamide
CID 126447092
4-(3-chloro-2-pyridinyl)-N-(4-pyrrolidin-1-ylsulfonylphenyl)benzamide
CID 59673279
4-(3-chloro-2-pyridinyl)-N-[1-(4-fluorophenyl)ethyl]benzamide
CID 59672700
N-[1-(3-chloro-2-pyridinyl)pyrrolidin-3-yl]benzamide
CID 166217661
N-cyclohexyl-4-(4-methyl-3-oxopyrido[2,3-b]pyrazin-2-yl)benzamide
CID 46393860
N-(4-aminocyclohexyl)-4-chlorobenzamide;hydrochloride
CID 86277368
N-cyclopropyl-4-[4-(cyclopropylamino)pyrimidin-2-yl]benzamide
CID 117084829

Frequently Asked Questions

What is the IUPAC name of 4-(3-chloro-2-pyridinyl)-N-cyclopropylbenzamide?
The IUPAC name of 4-(3-chloro-2-pyridinyl)-N-cyclopropylbenzamide (CID 59673165) is 4-(3-chloro-2-pyridinyl)-N-cyclopropylbenzamide.
What is the SMILES notation for 4-(3-chloro-2-pyridinyl)-N-cyclopropylbenzamide?
The canonical SMILES for 4-(3-chloro-2-pyridinyl)-N-cyclopropylbenzamide is O=C(NC1CC1)c1ccc(-c2ncccc2Cl)cc1.
What is the InChIKey of 4-(3-chloro-2-pyridinyl)-N-cyclopropylbenzamide?
The InChIKey is RFTVIIVCZNJAQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13ClN2O/c16-13-2-1-9-17-14(13)10-3-5-11(6-4-10)15(19)18-12-7-8-12/h1-6,9,12H,7-8H2,(H,18,19).
What are the key properties of 4-(3-chloro-2-pyridinyl)-N-cyclopropylbenzamide?
4-(3-chloro-2-pyridinyl)-N-cyclopropylbenzamide has a molecular weight of 272.74 g/mol, XLogP of 3.29, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-chloro-2-pyridinyl)-N-cyclopropylbenzamide is sourced from PubChem (CID 59673165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).