4-(4-chloro-2-methoxy-5-methylanilino)-N-cyclopentylpyridine-2-carboxamide

C19H22ClN3O2 — CID 109204162

IUPAC4-(4-chloro-2-methoxy-5-methylanilino)-N-cyclopentylpyridine-2-carboxamide
SMILESCOc1cc(Cl)c(C)cc1Nc1ccnc(C(=O)NC2CCCC2)c1
InChIInChI=1S/C19H22ClN3O2/c1-12-9-16(18(25-2)11-15(12)20)22-14-7-8-21-17(10-14)19(24)23-13-5-3-4-6-13/h7-11,13H,3-6H2,1-2H3,(H,21,22)(H,23,24)
InChIKeyQHSXJUSGITVOTG-UHFFFAOYSA-N
MW359.86 g/mol
LogP4.47
Rot. Bonds5

About 4-(4-chloro-2-methoxy-5-methylanilino)-N-cyclopentylpyridine-2-carboxamide

4-(4-chloro-2-methoxy-5-methylanilino)-N-cyclopentylpyridine-2-carboxamide (PubChem CID 109204162) has the molecular formula C19H22ClN3O2 and a molecular weight of 359.86 g/mol. Its IUPAC name is 4-(4-chloro-2-methoxy-5-methylanilino)-N-cyclopentylpyridine-2-carboxamide.

Molecular Properties

Compound Name4-(4-chloro-2-methoxy-5-methylanilino)-N-cyclopentylpyridine-2-carboxamide
PubChem CID109204162
Molecular FormulaC19H22ClN3O2
Molecular Weight359.86 g/mol
Exact Mass359.14
IUPAC Name4-(4-chloro-2-methoxy-5-methylanilino)-N-cyclopentylpyridine-2-carboxamide
SMILESCOc1cc(Cl)c(C)cc1Nc1ccnc(C(=O)NC2CCCC2)c1
InChIInChI=1S/C19H22ClN3O2/c1-12-9-16(18(25-2)11-15(12)20)22-14-7-8-21-17(10-14)19(24)23-13-5-3-4-6-13/h7-11,13H,3-6H2,1-2H3,(H,21,22)(H,23,24)
InChIKeyQHSXJUSGITVOTG-UHFFFAOYSA-N
XLogP4.47
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 ≤ 54.47
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-(5-chloro-2-methoxyanilino)-N-cyclohexylpyridine-2-carboxamide
CID 109204841
2-(4-chloro-2-methoxy-5-methylanilino)-N-cycloheptylpyrimidine-4-carboxamide
CID 109311611
4-(4-chloro-2-methylanilino)-N-cyclohexylpyridine-2-carboxamide
CID 109204837
N-cyclopentyl-4-(2-methylanilino)pyridine-2-carboxamide
CID 109204070
4-(4-chloro-2-methoxy-5-methylanilino)-N-(1-phenylethyl)pyridine-2-carboxamide
CID 109210740
4-(4-chloro-2-methoxy-5-methylanilino)pyridine-2-carbothioamide
CID 62924493
2-(4-chloro-2-methoxy-5-methylanilino)-N-cyclopentylpyrimidine-5-carboxamide
CID 109249701
6-(4-chloro-2-methoxy-5-methylanilino)-N-cyclopentylpyridine-3-carboxamide
CID 109152287
N-cyclopentyl-4-(2,3-dimethylanilino)pyridine-2-carboxamide
CID 109204081
N-(4-chloro-2-methoxy-5-methylphenyl)-4-hydrazinylpyridine-2-carboxamide
CID 62238327
[4-(4-chloro-2-methoxy-5-methylanilino)-2-pyridinyl]-morpholin-4-ylmethanone
CID 109206556

Frequently Asked Questions

What is the IUPAC name of 4-(4-chloro-2-methoxy-5-methylanilino)-N-cyclopentylpyridine-2-carboxamide?
The IUPAC name of 4-(4-chloro-2-methoxy-5-methylanilino)-N-cyclopentylpyridine-2-carboxamide (CID 109204162) is 4-(4-chloro-2-methoxy-5-methylanilino)-N-cyclopentylpyridine-2-carboxamide.
What is the SMILES notation for 4-(4-chloro-2-methoxy-5-methylanilino)-N-cyclopentylpyridine-2-carboxamide?
The canonical SMILES for 4-(4-chloro-2-methoxy-5-methylanilino)-N-cyclopentylpyridine-2-carboxamide is COc1cc(Cl)c(C)cc1Nc1ccnc(C(=O)NC2CCCC2)c1.
What is the InChIKey of 4-(4-chloro-2-methoxy-5-methylanilino)-N-cyclopentylpyridine-2-carboxamide?
The InChIKey is QHSXJUSGITVOTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22ClN3O2/c1-12-9-16(18(25-2)11-15(12)20)22-14-7-8-21-17(10-14)19(24)23-13-5-3-4-6-13/h7-11,13H,3-6H2,1-2H3,(H,21,22)(H,23,24).
What are the key properties of 4-(4-chloro-2-methoxy-5-methylanilino)-N-cyclopentylpyridine-2-carboxamide?
4-(4-chloro-2-methoxy-5-methylanilino)-N-cyclopentylpyridine-2-carboxamide has a molecular weight of 359.86 g/mol, XLogP of 4.47, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-chloro-2-methoxy-5-methylanilino)-N-cyclopentylpyridine-2-carboxamide is sourced from PubChem (CID 109204162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).