5-(4-chlorophenyl)-6-cyclobutyloxypyridine-2-carboxamide

C16H15ClN2O2 — CID 173468697

IUPAC5-(4-chlorophenyl)-6-cyclobutyloxypyridine-2-carboxamide
SMILESNC(=O)c1ccc(-c2ccc(Cl)cc2)c(OC2CCC2)n1
InChIInChI=1S/C16H15ClN2O2/c17-11-6-4-10(5-7-11)13-8-9-14(15(18)20)19-16(13)21-12-2-1-3-12/h4-9,12H,1-3H2,(H2,18,20)
InChIKeyJVCHNCXJRMVKKG-UHFFFAOYSA-N
MW302.76 g/mol
LogP3.43
Rot. Bonds4

About 5-(4-chlorophenyl)-6-cyclobutyloxypyridine-2-carboxamide

5-(4-chlorophenyl)-6-cyclobutyloxypyridine-2-carboxamide (PubChem CID 173468697) has the molecular formula C16H15ClN2O2 and a molecular weight of 302.76 g/mol. Its IUPAC name is 5-(4-chlorophenyl)-6-cyclobutyloxypyridine-2-carboxamide.

Molecular Properties

Compound Name5-(4-chlorophenyl)-6-cyclobutyloxypyridine-2-carboxamide
PubChem CID173468697
Molecular FormulaC16H15ClN2O2
Molecular Weight302.76 g/mol
Exact Mass302.08
IUPAC Name5-(4-chlorophenyl)-6-cyclobutyloxypyridine-2-carboxamide
SMILESNC(=O)c1ccc(-c2ccc(Cl)cc2)c(OC2CCC2)n1
InChIInChI=1S/C16H15ClN2O2/c17-11-6-4-10(5-7-11)13-8-9-14(15(18)20)19-16(13)21-12-2-1-3-12/h4-9,12H,1-3H2,(H2,18,20)
InChIKeyJVCHNCXJRMVKKG-UHFFFAOYSA-N
XLogP3.43
TPSA65.21 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 ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(4-chlorophenyl)-6-cyclobutyloxypyridine-2-carboxamide?
The IUPAC name of 5-(4-chlorophenyl)-6-cyclobutyloxypyridine-2-carboxamide (CID 173468697) is 5-(4-chlorophenyl)-6-cyclobutyloxypyridine-2-carboxamide.
What is the SMILES notation for 5-(4-chlorophenyl)-6-cyclobutyloxypyridine-2-carboxamide?
The canonical SMILES for 5-(4-chlorophenyl)-6-cyclobutyloxypyridine-2-carboxamide is NC(=O)c1ccc(-c2ccc(Cl)cc2)c(OC2CCC2)n1.
What is the InChIKey of 5-(4-chlorophenyl)-6-cyclobutyloxypyridine-2-carboxamide?
The InChIKey is JVCHNCXJRMVKKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15ClN2O2/c17-11-6-4-10(5-7-11)13-8-9-14(15(18)20)19-16(13)21-12-2-1-3-12/h4-9,12H,1-3H2,(H2,18,20).
What are the key properties of 5-(4-chlorophenyl)-6-cyclobutyloxypyridine-2-carboxamide?
5-(4-chlorophenyl)-6-cyclobutyloxypyridine-2-carboxamide has a molecular weight of 302.76 g/mol, XLogP of 3.43, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-chlorophenyl)-6-cyclobutyloxypyridine-2-carboxamide is sourced from PubChem (CID 173468697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).