3-N-(3-chlorophenyl)-5-N-cyclohexylpyridine-3,5-dicarboxamide

C19H20ClN3O2 — CID 109103090

IUPAC3-N-(3-chlorophenyl)-5-N-cyclohexylpyridine-3,5-dicarboxamide
SMILESO=C(Nc1cccc(Cl)c1)c1cncc(C(=O)NC2CCCCC2)c1
InChIInChI=1S/C19H20ClN3O2/c20-15-5-4-8-17(10-15)23-19(25)14-9-13(11-21-12-14)18(24)22-16-6-2-1-3-7-16/h4-5,8-12,16H,1-3,6-7H2,(H,22,24)(H,23,25)
InChIKeyRSSKBYZWUHTWIL-UHFFFAOYSA-N
MW357.84 g/mol
LogP4.05
Rot. Bonds4

About 3-N-(3-chlorophenyl)-5-N-cyclohexylpyridine-3,5-dicarboxamide

3-N-(3-chlorophenyl)-5-N-cyclohexylpyridine-3,5-dicarboxamide (PubChem CID 109103090) has the molecular formula C19H20ClN3O2 and a molecular weight of 357.84 g/mol. Its IUPAC name is 3-N-(3-chlorophenyl)-5-N-cyclohexylpyridine-3,5-dicarboxamide.

Molecular Properties

Compound Name3-N-(3-chlorophenyl)-5-N-cyclohexylpyridine-3,5-dicarboxamide
PubChem CID109103090
Molecular FormulaC19H20ClN3O2
Molecular Weight357.84 g/mol
Exact Mass357.12
IUPAC Name3-N-(3-chlorophenyl)-5-N-cyclohexylpyridine-3,5-dicarboxamide
SMILESO=C(Nc1cccc(Cl)c1)c1cncc(C(=O)NC2CCCCC2)c1
InChIInChI=1S/C19H20ClN3O2/c20-15-5-4-8-17(10-15)23-19(25)14-9-13(11-21-12-14)18(24)22-16-6-2-1-3-7-16/h4-5,8-12,16H,1-3,6-7H2,(H,22,24)(H,23,25)
InChIKeyRSSKBYZWUHTWIL-UHFFFAOYSA-N
XLogP4.05
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.84
LogP ≤ 54.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-N-(3-chlorophenyl)-5-N-cyclopentylpyridine-3,5-dicarboxamide
CID 109102765
4-N-(3-chlorophenyl)-1-N-cycloheptylbenzene-1,4-dicarboxamide
CID 109048558
5-N-cyclohexyl-3-N-phenylpyridine-3,5-dicarboxamide
CID 109103063
3-[(3-chlorobenzoyl)amino]-N-cyclohexylbenzamide
CID 17170567
5-N-cyclopentyl-3-N-(3,4-dichlorophenyl)pyridine-3,5-dicarboxamide
CID 109102814
3-N-(4-chloro-2-methylphenyl)-5-N-cyclohexylpyridine-3,5-dicarboxamide
CID 109103094
2-N-(3-chlorophenyl)-6-N-cyclopentylpyridine-2,6-dicarboxamide
CID 109095035
2-(3-chloroanilino)-N-cyclohexylpyrimidine-5-carboxamide
CID 109250380
2-(3-chloroanilino)-N-cycloheptylpyrimidine-5-carboxamide
CID 109263115
N-(3-chlorophenyl)-2-(cycloheptylamino)pyrimidine-5-carboxamide
CID 109263215
3-N-(3-chloro-4-methoxyphenyl)-5-N-cyclohexylpyridine-3,5-dicarboxamide
CID 109103098
1-N-(4-chlorophenyl)-3-N-cycloheptylbenzene-1,3-dicarboxamide
CID 109056113

Frequently Asked Questions

What is the IUPAC name of 3-N-(3-chlorophenyl)-5-N-cyclohexylpyridine-3,5-dicarboxamide?
The IUPAC name of 3-N-(3-chlorophenyl)-5-N-cyclohexylpyridine-3,5-dicarboxamide (CID 109103090) is 3-N-(3-chlorophenyl)-5-N-cyclohexylpyridine-3,5-dicarboxamide.
What is the SMILES notation for 3-N-(3-chlorophenyl)-5-N-cyclohexylpyridine-3,5-dicarboxamide?
The canonical SMILES for 3-N-(3-chlorophenyl)-5-N-cyclohexylpyridine-3,5-dicarboxamide is O=C(Nc1cccc(Cl)c1)c1cncc(C(=O)NC2CCCCC2)c1.
What is the InChIKey of 3-N-(3-chlorophenyl)-5-N-cyclohexylpyridine-3,5-dicarboxamide?
The InChIKey is RSSKBYZWUHTWIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20ClN3O2/c20-15-5-4-8-17(10-15)23-19(25)14-9-13(11-21-12-14)18(24)22-16-6-2-1-3-7-16/h4-5,8-12,16H,1-3,6-7H2,(H,22,24)(H,23,25).
What are the key properties of 3-N-(3-chlorophenyl)-5-N-cyclohexylpyridine-3,5-dicarboxamide?
3-N-(3-chlorophenyl)-5-N-cyclohexylpyridine-3,5-dicarboxamide has a molecular weight of 357.84 g/mol, XLogP of 4.05, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N-(3-chlorophenyl)-5-N-cyclohexylpyridine-3,5-dicarboxamide is sourced from PubChem (CID 109103090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).