N-(5-chloro-2-methylphenyl)-5-(cyclohexylamino)pyridine-2-carboxamide

C19H22ClN3O — CID 109183168

IUPACN-(5-chloro-2-methylphenyl)-5-(cyclohexylamino)pyridine-2-carboxamide
SMILESCc1ccc(Cl)cc1NC(=O)c1ccc(NC2CCCCC2)cn1
InChIInChI=1S/C19H22ClN3O/c1-13-7-8-14(20)11-18(13)23-19(24)17-10-9-16(12-21-17)22-15-5-3-2-4-6-15/h7-12,15,22H,2-6H2,1H3,(H,23,24)
InChIKeyMVIABJKWOYJAQO-UHFFFAOYSA-N
MW343.86 g/mol
LogP5.04
Rot. Bonds4

About N-(5-chloro-2-methylphenyl)-5-(cyclohexylamino)pyridine-2-carboxamide

N-(5-chloro-2-methylphenyl)-5-(cyclohexylamino)pyridine-2-carboxamide (PubChem CID 109183168) has the molecular formula C19H22ClN3O and a molecular weight of 343.86 g/mol. Its IUPAC name is N-(5-chloro-2-methylphenyl)-5-(cyclohexylamino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(5-chloro-2-methylphenyl)-5-(cyclohexylamino)pyridine-2-carboxamide
PubChem CID109183168
Molecular FormulaC19H22ClN3O
Molecular Weight343.86 g/mol
Exact Mass343.15
IUPAC NameN-(5-chloro-2-methylphenyl)-5-(cyclohexylamino)pyridine-2-carboxamide
SMILESCc1ccc(Cl)cc1NC(=O)c1ccc(NC2CCCCC2)cn1
InChIInChI=1S/C19H22ClN3O/c1-13-7-8-14(20)11-18(13)23-19(24)17-10-9-16(12-21-17)22-15-5-3-2-4-6-15/h7-12,15,22H,2-6H2,1H3,(H,23,24)
InChIKeyMVIABJKWOYJAQO-UHFFFAOYSA-N
XLogP5.04
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500343.86
LogP ≤ 55.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-(cycloheptylamino)-N-(2,3-dimethylphenyl)pyridine-2-carboxamide
CID 109195369
5-(cyclohexylamino)-N-(2,3,4-trifluorophenyl)pyridine-2-carboxamide
CID 109183232
5-(cyclopentylamino)-N-(3,5-dimethylphenyl)pyridine-2-carboxamide
CID 109182436
5-(cyclohexylamino)-N-(3,4-dichlorophenyl)pyridine-2-carboxamide
CID 109183218
5-(cyclohexylamino)-N-cyclopropylpyridine-2-carboxamide
CID 109179840
N-(2-chlorophenyl)-5-(cyclopentylamino)pyridine-2-carboxamide
CID 109182452
5-(cyclohexylamino)-N-[4-(diethylamino)-2-methylphenyl]pyridine-2-carboxamide
CID 109183226
5-(azepan-1-yl)-N-(5-chloro-2-methylphenyl)pyridine-2-carboxamide
CID 109196885
5-(cyclohexylamino)-N-(2-methoxyphenyl)pyridine-2-carboxamide
CID 109183176
5-(cyclohexylamino)-N-phenylpyridine-2-carboxamide
CID 109183141
5-(cyclohexylamino)-N-propan-2-ylpyridine-2-carboxamide
CID 109179444
N-(5-chloro-2-methylphenyl)-5-(3-methoxypropylamino)pyridine-2-carboxamide
CID 109184481

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-methylphenyl)-5-(cyclohexylamino)pyridine-2-carboxamide?
The IUPAC name of N-(5-chloro-2-methylphenyl)-5-(cyclohexylamino)pyridine-2-carboxamide (CID 109183168) is N-(5-chloro-2-methylphenyl)-5-(cyclohexylamino)pyridine-2-carboxamide.
What is the SMILES notation for N-(5-chloro-2-methylphenyl)-5-(cyclohexylamino)pyridine-2-carboxamide?
The canonical SMILES for N-(5-chloro-2-methylphenyl)-5-(cyclohexylamino)pyridine-2-carboxamide is Cc1ccc(Cl)cc1NC(=O)c1ccc(NC2CCCCC2)cn1.
What is the InChIKey of N-(5-chloro-2-methylphenyl)-5-(cyclohexylamino)pyridine-2-carboxamide?
The InChIKey is MVIABJKWOYJAQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22ClN3O/c1-13-7-8-14(20)11-18(13)23-19(24)17-10-9-16(12-21-17)22-15-5-3-2-4-6-15/h7-12,15,22H,2-6H2,1H3,(H,23,24).
What are the key properties of N-(5-chloro-2-methylphenyl)-5-(cyclohexylamino)pyridine-2-carboxamide?
N-(5-chloro-2-methylphenyl)-5-(cyclohexylamino)pyridine-2-carboxamide has a molecular weight of 343.86 g/mol, XLogP of 5.04, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-methylphenyl)-5-(cyclohexylamino)pyridine-2-carboxamide is sourced from PubChem (CID 109183168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).