1-(3-chlorophenyl)-N-(2-methyl-4-pyridinyl)cyclopropane-1-carboxamide

C16H15ClN2O — CID 110439726

IUPAC1-(3-chlorophenyl)-N-(2-methyl-4-pyridinyl)cyclopropane-1-carboxamide
SMILESCc1cc(NC(=O)C2(c3cccc(Cl)c3)CC2)ccn1
InChIInChI=1S/C16H15ClN2O/c1-11-9-14(5-8-18-11)19-15(20)16(6-7-16)12-3-2-4-13(17)10-12/h2-5,8-10H,6-7H2,1H3,(H,18,19,20)
InChIKeyJLMATYPFXFTYMZ-UHFFFAOYSA-N
MW286.76 g/mol
LogP3.71
Rot. Bonds3

About 1-(3-chlorophenyl)-N-(2-methyl-4-pyridinyl)cyclopropane-1-carboxamide

1-(3-chlorophenyl)-N-(2-methyl-4-pyridinyl)cyclopropane-1-carboxamide (PubChem CID 110439726) has the molecular formula C16H15ClN2O and a molecular weight of 286.76 g/mol. Its IUPAC name is 1-(3-chlorophenyl)-N-(2-methyl-4-pyridinyl)cyclopropane-1-carboxamide.

Molecular Properties

Compound Name1-(3-chlorophenyl)-N-(2-methyl-4-pyridinyl)cyclopropane-1-carboxamide
PubChem CID110439726
Molecular FormulaC16H15ClN2O
Molecular Weight286.76 g/mol
Exact Mass286.09
IUPAC Name1-(3-chlorophenyl)-N-(2-methyl-4-pyridinyl)cyclopropane-1-carboxamide
SMILESCc1cc(NC(=O)C2(c3cccc(Cl)c3)CC2)ccn1
InChIInChI=1S/C16H15ClN2O/c1-11-9-14(5-8-18-11)19-15(20)16(6-7-16)12-3-2-4-13(17)10-12/h2-5,8-10H,6-7H2,1H3,(H,18,19,20)
InChIKeyJLMATYPFXFTYMZ-UHFFFAOYSA-N
XLogP3.71
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.76
LogP ≤ 53.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-acetamidophenyl)-1-(3-chlorophenyl)cyclopropane-1-carboxamide
CID 110439128
1-(3-chlorophenyl)-N-pyridin-4-ylcyclohexane-1-carboxamide
CID 60542537
1-(3-chlorophenyl)-N-(4-methoxyphenyl)cyclopropane-1-carboxamide
CID 110439114
1-(3-chlorophenyl)-N-[4-(dimethylamino)phenyl]cyclopropane-1-carboxamide
CID 110439132
N-(5-acetamido-2-methylphenyl)-1-(3-chlorophenyl)cyclopropane-1-carboxamide
CID 110439155
1-(3-chlorophenyl)-N-(3-fluorophenyl)cyclobutane-1-carboxamide
CID 31779380
1-(2-methoxyphenyl)-N-(2-methyl-4-pyridinyl)cyclopropane-1-carboxamide
CID 110439650
1-(3-chlorophenyl)-N-[2-methyl-5-(2-methylpropanoylamino)phenyl]cyclopropane-1-carboxamide
CID 55764960
4-[[1-(3-chlorophenyl)cyclopropanecarbonyl]amino]-N-propan-2-ylbenzamide
CID 55887284
1-(3-chlorophenyl)-N-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]cyclopropane-1-carboxamide
CID 37049250
N-(5-acetamido-2-pyridinyl)-1-(3-chlorophenyl)cyclopentane-1-carboxamide
CID 139002279
4-(3-chlorophenyl)-N-(2-methyl-1,3-benzoxazol-6-yl)oxane-4-carboxamide
CID 86828959

Frequently Asked Questions

What is the IUPAC name of 1-(3-chlorophenyl)-N-(2-methyl-4-pyridinyl)cyclopropane-1-carboxamide?
The IUPAC name of 1-(3-chlorophenyl)-N-(2-methyl-4-pyridinyl)cyclopropane-1-carboxamide (CID 110439726) is 1-(3-chlorophenyl)-N-(2-methyl-4-pyridinyl)cyclopropane-1-carboxamide.
What is the SMILES notation for 1-(3-chlorophenyl)-N-(2-methyl-4-pyridinyl)cyclopropane-1-carboxamide?
The canonical SMILES for 1-(3-chlorophenyl)-N-(2-methyl-4-pyridinyl)cyclopropane-1-carboxamide is Cc1cc(NC(=O)C2(c3cccc(Cl)c3)CC2)ccn1.
What is the InChIKey of 1-(3-chlorophenyl)-N-(2-methyl-4-pyridinyl)cyclopropane-1-carboxamide?
The InChIKey is JLMATYPFXFTYMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15ClN2O/c1-11-9-14(5-8-18-11)19-15(20)16(6-7-16)12-3-2-4-13(17)10-12/h2-5,8-10H,6-7H2,1H3,(H,18,19,20).
What are the key properties of 1-(3-chlorophenyl)-N-(2-methyl-4-pyridinyl)cyclopropane-1-carboxamide?
1-(3-chlorophenyl)-N-(2-methyl-4-pyridinyl)cyclopropane-1-carboxamide has a molecular weight of 286.76 g/mol, XLogP of 3.71, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-chlorophenyl)-N-(2-methyl-4-pyridinyl)cyclopropane-1-carboxamide is sourced from PubChem (CID 110439726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).