4-N-(4-chloro-2-methylphenyl)-2-N-cyclohexylpyridine-2,4-dicarboxamide

C20H22ClN3O2 — CID 109081597

IUPAC4-N-(4-chloro-2-methylphenyl)-2-N-cyclohexylpyridine-2,4-dicarboxamide
SMILESCc1cc(Cl)ccc1NC(=O)c1ccnc(C(=O)NC2CCCCC2)c1
InChIInChI=1S/C20H22ClN3O2/c1-13-11-15(21)7-8-17(13)24-19(25)14-9-10-22-18(12-14)20(26)23-16-5-3-2-4-6-16/h7-12,16H,2-6H2,1H3,(H,23,26)(H,24,25)
InChIKeyOMAIPXVQAWCTPA-UHFFFAOYSA-N
MW371.87 g/mol
LogP4.36
Rot. Bonds4

About 4-N-(4-chloro-2-methylphenyl)-2-N-cyclohexylpyridine-2,4-dicarboxamide

4-N-(4-chloro-2-methylphenyl)-2-N-cyclohexylpyridine-2,4-dicarboxamide (PubChem CID 109081597) has the molecular formula C20H22ClN3O2 and a molecular weight of 371.87 g/mol. Its IUPAC name is 4-N-(4-chloro-2-methylphenyl)-2-N-cyclohexylpyridine-2,4-dicarboxamide.

Molecular Properties

Compound Name4-N-(4-chloro-2-methylphenyl)-2-N-cyclohexylpyridine-2,4-dicarboxamide
PubChem CID109081597
Molecular FormulaC20H22ClN3O2
Molecular Weight371.87 g/mol
Exact Mass371.14
IUPAC Name4-N-(4-chloro-2-methylphenyl)-2-N-cyclohexylpyridine-2,4-dicarboxamide
SMILESCc1cc(Cl)ccc1NC(=O)c1ccnc(C(=O)NC2CCCCC2)c1
InChIInChI=1S/C20H22ClN3O2/c1-13-11-15(21)7-8-17(13)24-19(25)14-9-10-22-18(12-14)20(26)23-16-5-3-2-4-6-16/h7-12,16H,2-6H2,1H3,(H,23,26)(H,24,25)
InChIKeyOMAIPXVQAWCTPA-UHFFFAOYSA-N
XLogP4.36
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.87
LogP ≤ 54.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-N-(4-chloro-2-methylphenyl)-2-N-cyclopentylpyridine-2,4-dicarboxamide
CID 109080960
2-N-(4-chloro-2-methylphenyl)-4-N-cyclopropylpyridine-2,4-dicarboxamide
CID 109078521
4-N-(5-chloro-2-methylphenyl)-2-N-cyclopentylpyridine-2,4-dicarboxamide
CID 109080959
2-N-cyclohexyl-4-N-(2,4-dichlorophenyl)pyridine-2,4-dicarboxamide
CID 109081635
4-N-(5-chloro-2-methylphenyl)-2-N-cyclopropylpyridine-2,4-dicarboxamide
CID 109078715
2-N-cycloheptyl-4-N-(2-methylphenyl)pyridine-2,4-dicarboxamide
CID 109089442
4-(4-chloro-2-methylanilino)-N-cyclohexylpyridine-2-carboxamide
CID 109204837
3-N-(4-chloro-2-methylphenyl)-5-N-cyclohexylpyridine-3,5-dicarboxamide
CID 109103094
4-N-(3-chloro-4-methylphenyl)-2-N-cyclopentylpyridine-2,4-dicarboxamide
CID 109080961
2-N-(5-chloro-2-methoxyphenyl)-4-N-cyclohexylpyridine-2,4-dicarboxamide
CID 109081455
2-N-cyclopentyl-4-N-(3,5-dichlorophenyl)pyridine-2,4-dicarboxamide
CID 109081008
4-N-cycloheptyl-2-N-(2,3-dimethylphenyl)pyridine-2,4-dicarboxamide
CID 109089379

Frequently Asked Questions

What is the IUPAC name of 4-N-(4-chloro-2-methylphenyl)-2-N-cyclohexylpyridine-2,4-dicarboxamide?
The IUPAC name of 4-N-(4-chloro-2-methylphenyl)-2-N-cyclohexylpyridine-2,4-dicarboxamide (CID 109081597) is 4-N-(4-chloro-2-methylphenyl)-2-N-cyclohexylpyridine-2,4-dicarboxamide.
What is the SMILES notation for 4-N-(4-chloro-2-methylphenyl)-2-N-cyclohexylpyridine-2,4-dicarboxamide?
The canonical SMILES for 4-N-(4-chloro-2-methylphenyl)-2-N-cyclohexylpyridine-2,4-dicarboxamide is Cc1cc(Cl)ccc1NC(=O)c1ccnc(C(=O)NC2CCCCC2)c1.
What is the InChIKey of 4-N-(4-chloro-2-methylphenyl)-2-N-cyclohexylpyridine-2,4-dicarboxamide?
The InChIKey is OMAIPXVQAWCTPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22ClN3O2/c1-13-11-15(21)7-8-17(13)24-19(25)14-9-10-22-18(12-14)20(26)23-16-5-3-2-4-6-16/h7-12,16H,2-6H2,1H3,(H,23,26)(H,24,25).
What are the key properties of 4-N-(4-chloro-2-methylphenyl)-2-N-cyclohexylpyridine-2,4-dicarboxamide?
4-N-(4-chloro-2-methylphenyl)-2-N-cyclohexylpyridine-2,4-dicarboxamide has a molecular weight of 371.87 g/mol, XLogP of 4.36, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-(4-chloro-2-methylphenyl)-2-N-cyclohexylpyridine-2,4-dicarboxamide is sourced from PubChem (CID 109081597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).