2-N-(3-chlorophenyl)-6-N-cyclopropylpyridine-2,6-dicarboxamide

C16H14ClN3O2 — CID 109093921

IUPAC2-N-(3-chlorophenyl)-6-N-cyclopropylpyridine-2,6-dicarboxamide
SMILESO=C(Nc1cccc(Cl)c1)c1cccc(C(=O)NC2CC2)n1
InChIInChI=1S/C16H14ClN3O2/c17-10-3-1-4-12(9-10)19-16(22)14-6-2-5-13(20-14)15(21)18-11-7-8-11/h1-6,9,11H,7-8H2,(H,18,21)(H,19,22)
InChIKeyNZFCFIXSMNDUMS-UHFFFAOYSA-N
MW315.76 g/mol
LogP2.88
Rot. Bonds4

About 2-N-(3-chlorophenyl)-6-N-cyclopropylpyridine-2,6-dicarboxamide

2-N-(3-chlorophenyl)-6-N-cyclopropylpyridine-2,6-dicarboxamide (PubChem CID 109093921) has the molecular formula C16H14ClN3O2 and a molecular weight of 315.76 g/mol. Its IUPAC name is 2-N-(3-chlorophenyl)-6-N-cyclopropylpyridine-2,6-dicarboxamide.

Molecular Properties

Compound Name2-N-(3-chlorophenyl)-6-N-cyclopropylpyridine-2,6-dicarboxamide
PubChem CID109093921
Molecular FormulaC16H14ClN3O2
Molecular Weight315.76 g/mol
Exact Mass315.08
IUPAC Name2-N-(3-chlorophenyl)-6-N-cyclopropylpyridine-2,6-dicarboxamide
SMILESO=C(Nc1cccc(Cl)c1)c1cccc(C(=O)NC2CC2)n1
InChIInChI=1S/C16H14ClN3O2/c17-10-3-1-4-12(9-10)19-16(22)14-6-2-5-13(20-14)15(21)18-11-7-8-11/h1-6,9,11H,7-8H2,(H,18,21)(H,19,22)
InChIKeyNZFCFIXSMNDUMS-UHFFFAOYSA-N
XLogP2.88
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.76
LogP ≤ 52.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-N-(3-chlorophenyl)-6-N-cyclopentylpyridine-2,6-dicarboxamide
CID 109095035
6-N-cyclopropyl-2-N-[3-(trifluoromethyl)phenyl]pyridine-2,6-dicarboxamide
CID 109093945
2-N-(3-acetylphenyl)-6-N-cyclohexylpyridine-2,6-dicarboxamide
CID 109095376
6-N-cyclopropyl-2-N-(2,3-dihydro-1,4-benzodioxin-6-yl)pyridine-2,6-dicarboxamide
CID 109093973
4-N-(3-chlorophenyl)-1-N-cycloheptylbenzene-1,4-dicarboxamide
CID 109048558
6-N-cyclopentyl-2-N-(2,5-dichlorophenyl)pyridine-2,6-dicarboxamide
CID 109095085
6-N-cyclohexyl-2-N-[3-(trifluoromethyl)phenyl]pyridine-2,6-dicarboxamide
CID 109095374
6-N-cyclopropyl-2-N-[4-(dimethylamino)phenyl]pyridine-2,6-dicarboxamide
CID 109093956
2-N-cycloheptyl-6-N-cyclopropylpyridine-2,6-dicarboxamide
CID 109093881
2-N-(3-acetylphenyl)-6-N-(3-chlorophenyl)pyridine-2,6-dicarboxamide
CID 109100836
3-N-(3-chlorophenyl)-5-N-cyclopentylpyridine-3,5-dicarboxamide
CID 109102765
N-(3-chlorophenyl)-6-methylpyridine-2-carboxamide
CID 31698646

Frequently Asked Questions

What is the IUPAC name of 2-N-(3-chlorophenyl)-6-N-cyclopropylpyridine-2,6-dicarboxamide?
The IUPAC name of 2-N-(3-chlorophenyl)-6-N-cyclopropylpyridine-2,6-dicarboxamide (CID 109093921) is 2-N-(3-chlorophenyl)-6-N-cyclopropylpyridine-2,6-dicarboxamide.
What is the SMILES notation for 2-N-(3-chlorophenyl)-6-N-cyclopropylpyridine-2,6-dicarboxamide?
The canonical SMILES for 2-N-(3-chlorophenyl)-6-N-cyclopropylpyridine-2,6-dicarboxamide is O=C(Nc1cccc(Cl)c1)c1cccc(C(=O)NC2CC2)n1.
What is the InChIKey of 2-N-(3-chlorophenyl)-6-N-cyclopropylpyridine-2,6-dicarboxamide?
The InChIKey is NZFCFIXSMNDUMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14ClN3O2/c17-10-3-1-4-12(9-10)19-16(22)14-6-2-5-13(20-14)15(21)18-11-7-8-11/h1-6,9,11H,7-8H2,(H,18,21)(H,19,22).
What are the key properties of 2-N-(3-chlorophenyl)-6-N-cyclopropylpyridine-2,6-dicarboxamide?
2-N-(3-chlorophenyl)-6-N-cyclopropylpyridine-2,6-dicarboxamide has a molecular weight of 315.76 g/mol, XLogP of 2.88, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(3-chlorophenyl)-6-N-cyclopropylpyridine-2,6-dicarboxamide is sourced from PubChem (CID 109093921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).