N-[1-(3-chlorophenyl)cyclopropyl]pyridine-2-carboxamide

C15H13ClN2O — CID 110444338

IUPACN-[1-(3-chlorophenyl)cyclopropyl]pyridine-2-carboxamide
SMILESO=C(NC1(c2cccc(Cl)c2)CC1)c1ccccn1
InChIInChI=1S/C15H13ClN2O/c16-12-5-3-4-11(10-12)15(7-8-15)18-14(19)13-6-1-2-9-17-13/h1-6,9-10H,7-8H2,(H,18,19)
InChIKeyKOERULMBRGJVDX-UHFFFAOYSA-N
MW272.74 g/mol
LogP3.15
Rot. Bonds3

About N-[1-(3-chlorophenyl)cyclopropyl]pyridine-2-carboxamide

N-[1-(3-chlorophenyl)cyclopropyl]pyridine-2-carboxamide (PubChem CID 110444338) has the molecular formula C15H13ClN2O and a molecular weight of 272.74 g/mol. Its IUPAC name is N-[1-(3-chlorophenyl)cyclopropyl]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[1-(3-chlorophenyl)cyclopropyl]pyridine-2-carboxamide
PubChem CID110444338
Molecular FormulaC15H13ClN2O
Molecular Weight272.74 g/mol
Exact Mass272.07
IUPAC NameN-[1-(3-chlorophenyl)cyclopropyl]pyridine-2-carboxamide
SMILESO=C(NC1(c2cccc(Cl)c2)CC1)c1ccccn1
InChIInChI=1S/C15H13ClN2O/c16-12-5-3-4-11(10-12)15(7-8-15)18-14(19)13-6-1-2-9-17-13/h1-6,9-10H,7-8H2,(H,18,19)
InChIKeyKOERULMBRGJVDX-UHFFFAOYSA-N
XLogP3.15
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 ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[1-(3-chlorophenyl)cyclopropyl]carbamic acid
CID 122529573
2,5-dichloro-N-[1-(3-chlorophenyl)cyclopropyl]benzamide
CID 110440796
N-[1-(3-bromophenyl)cyclobutyl]-4-chloropyridine-2-carboxamide
CID 55983214
N-[1-(3-chlorophenyl)cyclopropyl]-4-methylbenzamide
CID 110440424
N-[1-(3-chlorophenyl)cyclopropyl]-4-fluorobenzamide
CID 110441685
N-[1-(3-chlorophenyl)cyclopropyl]-2-methoxybenzamide
CID 110443934
N-[1-(3-chlorophenyl)cyclopentyl]-1H-pyrazole-4-carboxamide
CID 136515658
N-[1-(3-chlorophenyl)cyclopropyl]-3H-benzimidazole-5-carboxamide
CID 110444805
2-chloro-N-[1-(3-chlorophenyl)cyclopropyl]-6-fluorobenzamide
CID 110445814
N-[1-(3-chlorophenyl)cyclopropyl]piperidine-4-carboxamide
CID 110462274
N-[1-(3-chlorophenyl)cyclopentyl]-5-phenyl-2H-triazole-4-carboxamide
CID 166245513
N-[1-(3-chlorophenyl)cyclopentyl]acetamide
CID 110441196

Frequently Asked Questions

What is the IUPAC name of N-[1-(3-chlorophenyl)cyclopropyl]pyridine-2-carboxamide?
The IUPAC name of N-[1-(3-chlorophenyl)cyclopropyl]pyridine-2-carboxamide (CID 110444338) is N-[1-(3-chlorophenyl)cyclopropyl]pyridine-2-carboxamide.
What is the SMILES notation for N-[1-(3-chlorophenyl)cyclopropyl]pyridine-2-carboxamide?
The canonical SMILES for N-[1-(3-chlorophenyl)cyclopropyl]pyridine-2-carboxamide is O=C(NC1(c2cccc(Cl)c2)CC1)c1ccccn1.
What is the InChIKey of N-[1-(3-chlorophenyl)cyclopropyl]pyridine-2-carboxamide?
The InChIKey is KOERULMBRGJVDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13ClN2O/c16-12-5-3-4-11(10-12)15(7-8-15)18-14(19)13-6-1-2-9-17-13/h1-6,9-10H,7-8H2,(H,18,19).
What are the key properties of N-[1-(3-chlorophenyl)cyclopropyl]pyridine-2-carboxamide?
N-[1-(3-chlorophenyl)cyclopropyl]pyridine-2-carboxamide has a molecular weight of 272.74 g/mol, XLogP of 3.15, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3-chlorophenyl)cyclopropyl]pyridine-2-carboxamide is sourced from PubChem (CID 110444338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).