4-(5-chloro-2-methoxyanilino)-N-cyclohexylpyridine-2-carboxamide

C19H22ClN3O2 — CID 109204841

IUPAC4-(5-chloro-2-methoxyanilino)-N-cyclohexylpyridine-2-carboxamide
SMILESCOc1ccc(Cl)cc1Nc1ccnc(C(=O)NC2CCCCC2)c1
InChIInChI=1S/C19H22ClN3O2/c1-25-18-8-7-13(20)11-16(18)22-15-9-10-21-17(12-15)19(24)23-14-5-3-2-4-6-14/h7-12,14H,2-6H2,1H3,(H,21,22)(H,23,24)
InChIKeyUBRWUMVBXHUIKS-UHFFFAOYSA-N
MW359.86 g/mol
LogP4.55
Rot. Bonds5

About 4-(5-chloro-2-methoxyanilino)-N-cyclohexylpyridine-2-carboxamide

4-(5-chloro-2-methoxyanilino)-N-cyclohexylpyridine-2-carboxamide (PubChem CID 109204841) has the molecular formula C19H22ClN3O2 and a molecular weight of 359.86 g/mol. Its IUPAC name is 4-(5-chloro-2-methoxyanilino)-N-cyclohexylpyridine-2-carboxamide.

Molecular Properties

Compound Name4-(5-chloro-2-methoxyanilino)-N-cyclohexylpyridine-2-carboxamide
PubChem CID109204841
Molecular FormulaC19H22ClN3O2
Molecular Weight359.86 g/mol
Exact Mass359.14
IUPAC Name4-(5-chloro-2-methoxyanilino)-N-cyclohexylpyridine-2-carboxamide
SMILESCOc1ccc(Cl)cc1Nc1ccnc(C(=O)NC2CCCCC2)c1
InChIInChI=1S/C19H22ClN3O2/c1-25-18-8-7-13(20)11-16(18)22-15-9-10-21-17(12-15)19(24)23-14-5-3-2-4-6-14/h7-12,14H,2-6H2,1H3,(H,21,22)(H,23,24)
InChIKeyUBRWUMVBXHUIKS-UHFFFAOYSA-N
XLogP4.55
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.86
LogP ≤ 54.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-(4-chloro-2-methoxy-5-methylanilino)-N-cyclohexylpyridine-2-carboxamide
CID 109204886
4-(4-chloro-2-methoxy-5-methylanilino)-N-cyclopentylpyridine-2-carboxamide
CID 109204162
4-(4-chloro-2-methylanilino)-N-cyclohexylpyridine-2-carboxamide
CID 109204837
2-N-(5-chloro-2-methoxyphenyl)-4-N-cyclohexylpyridine-2,4-dicarboxamide
CID 109081455
4-[[2-(5-chloro-2-methoxyphenyl)acetyl]amino]-N-cyclohexylpyridine-2-carboxamide
CID 139347906
4-(4-chloroanilino)-N-cyclopentylpyridine-2-carboxamide
CID 109204096
4-(5-chloro-2-methoxyanilino)-N-(2-methoxy-5-methylphenyl)pyridine-2-carboxamide
CID 109221419
2-N-(5-chloro-2-methoxyphenyl)-6-N-cyclopentylpyridine-2,6-dicarboxamide
CID 109095044
6-(5-chloro-2-methoxyanilino)-N-cyclohexylpyridine-3-carboxamide
CID 109152496
N-(3-acetylphenyl)-4-(5-chloro-2-methoxyanilino)pyridine-2-carboxamide
CID 109221420
N-cyclohexyl-4-[(3,4-dimethoxyphenyl)methylamino]pyridine-2-carboxamide
CID 109204782
1-(5-chloro-2-methoxyphenyl)-3-cyclododecylurea
CID 108875500

Frequently Asked Questions

What is the IUPAC name of 4-(5-chloro-2-methoxyanilino)-N-cyclohexylpyridine-2-carboxamide?
The IUPAC name of 4-(5-chloro-2-methoxyanilino)-N-cyclohexylpyridine-2-carboxamide (CID 109204841) is 4-(5-chloro-2-methoxyanilino)-N-cyclohexylpyridine-2-carboxamide.
What is the SMILES notation for 4-(5-chloro-2-methoxyanilino)-N-cyclohexylpyridine-2-carboxamide?
The canonical SMILES for 4-(5-chloro-2-methoxyanilino)-N-cyclohexylpyridine-2-carboxamide is COc1ccc(Cl)cc1Nc1ccnc(C(=O)NC2CCCCC2)c1.
What is the InChIKey of 4-(5-chloro-2-methoxyanilino)-N-cyclohexylpyridine-2-carboxamide?
The InChIKey is UBRWUMVBXHUIKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22ClN3O2/c1-25-18-8-7-13(20)11-16(18)22-15-9-10-21-17(12-15)19(24)23-14-5-3-2-4-6-14/h7-12,14H,2-6H2,1H3,(H,21,22)(H,23,24).
What are the key properties of 4-(5-chloro-2-methoxyanilino)-N-cyclohexylpyridine-2-carboxamide?
4-(5-chloro-2-methoxyanilino)-N-cyclohexylpyridine-2-carboxamide has a molecular weight of 359.86 g/mol, XLogP of 4.55, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-chloro-2-methoxyanilino)-N-cyclohexylpyridine-2-carboxamide is sourced from PubChem (CID 109204841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).