N-[1-(2-chlorophenyl)cyclopropyl]-4-methoxypyridine-2-carboxamide

C16H15ClN2O2 — CID 122559882

IUPACN-[1-(2-chlorophenyl)cyclopropyl]-4-methoxypyridine-2-carboxamide
SMILESCOc1ccnc(C(=O)NC2(c3ccccc3Cl)CC2)c1
InChIInChI=1S/C16H15ClN2O2/c1-21-11-6-9-18-14(10-11)15(20)19-16(7-8-16)12-4-2-3-5-13(12)17/h2-6,9-10H,7-8H2,1H3,(H,19,20)
InChIKeyDHINBBDXGQUATC-UHFFFAOYSA-N
MW302.76 g/mol
LogP3.16
Rot. Bonds4

About N-[1-(2-chlorophenyl)cyclopropyl]-4-methoxypyridine-2-carboxamide

N-[1-(2-chlorophenyl)cyclopropyl]-4-methoxypyridine-2-carboxamide (PubChem CID 122559882) has the molecular formula C16H15ClN2O2 and a molecular weight of 302.76 g/mol. Its IUPAC name is N-[1-(2-chlorophenyl)cyclopropyl]-4-methoxypyridine-2-carboxamide.

Molecular Properties

Compound NameN-[1-(2-chlorophenyl)cyclopropyl]-4-methoxypyridine-2-carboxamide
PubChem CID122559882
Molecular FormulaC16H15ClN2O2
Molecular Weight302.76 g/mol
Exact Mass302.08
IUPAC NameN-[1-(2-chlorophenyl)cyclopropyl]-4-methoxypyridine-2-carboxamide
SMILESCOc1ccnc(C(=O)NC2(c3ccccc3Cl)CC2)c1
InChIInChI=1S/C16H15ClN2O2/c1-21-11-6-9-18-14(10-11)15(20)19-16(7-8-16)12-4-2-3-5-13(12)17/h2-6,9-10H,7-8H2,1H3,(H,19,20)
InChIKeyDHINBBDXGQUATC-UHFFFAOYSA-N
XLogP3.16
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.76
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(2,5-difluorophenyl)cyclopropyl]-4-methoxypyridine-2-carboxamide
CID 122562392
N-[1-(2-chlorophenyl)-4-methylpyrazol-3-yl]-4-methoxypyridine-2-carboxamide
CID 97157903
1-[1-(2-chlorophenyl)cyclopentyl]-3-(3-methoxyphenyl)thiourea
CID 100766026
4-(3-methoxyanilino)-N-phenylpyridine-2-carboxamide
CID 109218773
N-[1-(3-chlorophenyl)cyclopropyl]pyridine-2-carboxamide
CID 110444338
4-methoxy-N-[3-(piperidine-1-carbonyl)phenyl]pyridine-2-carboxamide
CID 99249750
N-[1-(2-methoxyphenyl)cyclopropyl]-1H-imidazole-2-carboxamide
CID 110466575
methyl 2-(4-methoxy-2-pyridinyl)prop-2-enoate
CID 174428157
CID 169248442
CID 169248442
4-(3-chloro-4-methylanilino)-N-(3-methoxyphenyl)pyridine-2-carboxamide
CID 109221266
N-(2,4-dichlorophenyl)-4-(3-methoxyanilino)pyridine-2-carboxamide
CID 109221628
N-(3-methoxyphenyl)-4-pyrrolidin-1-ylpyridine-2-carboxamide
CID 109203921

Frequently Asked Questions

What is the IUPAC name of N-[1-(2-chlorophenyl)cyclopropyl]-4-methoxypyridine-2-carboxamide?
The IUPAC name of N-[1-(2-chlorophenyl)cyclopropyl]-4-methoxypyridine-2-carboxamide (CID 122559882) is N-[1-(2-chlorophenyl)cyclopropyl]-4-methoxypyridine-2-carboxamide.
What is the SMILES notation for N-[1-(2-chlorophenyl)cyclopropyl]-4-methoxypyridine-2-carboxamide?
The canonical SMILES for N-[1-(2-chlorophenyl)cyclopropyl]-4-methoxypyridine-2-carboxamide is COc1ccnc(C(=O)NC2(c3ccccc3Cl)CC2)c1.
What is the InChIKey of N-[1-(2-chlorophenyl)cyclopropyl]-4-methoxypyridine-2-carboxamide?
The InChIKey is DHINBBDXGQUATC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15ClN2O2/c1-21-11-6-9-18-14(10-11)15(20)19-16(7-8-16)12-4-2-3-5-13(12)17/h2-6,9-10H,7-8H2,1H3,(H,19,20).
What are the key properties of N-[1-(2-chlorophenyl)cyclopropyl]-4-methoxypyridine-2-carboxamide?
N-[1-(2-chlorophenyl)cyclopropyl]-4-methoxypyridine-2-carboxamide has a molecular weight of 302.76 g/mol, XLogP of 3.16, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-chlorophenyl)cyclopropyl]-4-methoxypyridine-2-carboxamide is sourced from PubChem (CID 122559882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).