5-(cyclohexylamino)-N-(3,4-dichlorophenyl)pyridine-2-carboxamide

C18H19Cl2N3O — CID 109183218

IUPAC5-(cyclohexylamino)-N-(3,4-dichlorophenyl)pyridine-2-carboxamide
SMILESO=C(Nc1ccc(Cl)c(Cl)c1)c1ccc(NC2CCCCC2)cn1
InChIInChI=1S/C18H19Cl2N3O/c19-15-8-6-13(10-16(15)20)23-18(24)17-9-7-14(11-21-17)22-12-4-2-1-3-5-12/h6-12,22H,1-5H2,(H,23,24)
InChIKeyQTQJTKOLPPAKRS-UHFFFAOYSA-N
MW364.28 g/mol
LogP5.39
Rot. Bonds4

About 5-(cyclohexylamino)-N-(3,4-dichlorophenyl)pyridine-2-carboxamide

5-(cyclohexylamino)-N-(3,4-dichlorophenyl)pyridine-2-carboxamide (PubChem CID 109183218) has the molecular formula C18H19Cl2N3O and a molecular weight of 364.28 g/mol. Its IUPAC name is 5-(cyclohexylamino)-N-(3,4-dichlorophenyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name5-(cyclohexylamino)-N-(3,4-dichlorophenyl)pyridine-2-carboxamide
PubChem CID109183218
Molecular FormulaC18H19Cl2N3O
Molecular Weight364.28 g/mol
Exact Mass363.09
IUPAC Name5-(cyclohexylamino)-N-(3,4-dichlorophenyl)pyridine-2-carboxamide
SMILESO=C(Nc1ccc(Cl)c(Cl)c1)c1ccc(NC2CCCCC2)cn1
InChIInChI=1S/C18H19Cl2N3O/c19-15-8-6-13(10-16(15)20)23-18(24)17-9-7-14(11-21-17)22-12-4-2-1-3-5-12/h6-12,22H,1-5H2,(H,23,24)
InChIKeyQTQJTKOLPPAKRS-UHFFFAOYSA-N
XLogP5.39
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500364.28
LogP ≤ 55.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-chloro-3-(trifluoromethyl)phenyl]-5-(cyclopentylamino)pyridine-2-carboxamide
CID 109182511
5-(cyclohexylamino)-N-phenylpyridine-2-carboxamide
CID 109183141
5-(cyclohexylamino)-N-(3-fluorophenyl)pyridine-2-carboxamide
CID 109183205
5-(cyclopentylamino)-N-(3,5-dimethylphenyl)pyridine-2-carboxamide
CID 109182436
5-(cyclohexylamino)-N-cyclopropylpyridine-2-carboxamide
CID 109179840
N-(3-acetamidophenyl)-5-(cyclopropylamino)pyridine-2-carboxamide
CID 109180174
N-(2-chlorophenyl)-5-(cyclopentylamino)pyridine-2-carboxamide
CID 109182452
N-(4-tert-butylphenyl)-5-(cyclopentylamino)pyridine-2-carboxamide
CID 109182449
5-(cyclohexylamino)-N-propan-2-ylpyridine-2-carboxamide
CID 109179444
N-(5-chloro-2-methylphenyl)-5-(cyclohexylamino)pyridine-2-carboxamide
CID 109183168
N-(3,4-dichlorophenyl)-5-(methylamino)pyridine-2-carboxamide
CID 104639765
5-(cyclopropylamino)-N-(4-propan-2-ylphenyl)pyridine-2-carboxamide
CID 109180137

Frequently Asked Questions

What is the IUPAC name of 5-(cyclohexylamino)-N-(3,4-dichlorophenyl)pyridine-2-carboxamide?
The IUPAC name of 5-(cyclohexylamino)-N-(3,4-dichlorophenyl)pyridine-2-carboxamide (CID 109183218) is 5-(cyclohexylamino)-N-(3,4-dichlorophenyl)pyridine-2-carboxamide.
What is the SMILES notation for 5-(cyclohexylamino)-N-(3,4-dichlorophenyl)pyridine-2-carboxamide?
The canonical SMILES for 5-(cyclohexylamino)-N-(3,4-dichlorophenyl)pyridine-2-carboxamide is O=C(Nc1ccc(Cl)c(Cl)c1)c1ccc(NC2CCCCC2)cn1.
What is the InChIKey of 5-(cyclohexylamino)-N-(3,4-dichlorophenyl)pyridine-2-carboxamide?
The InChIKey is QTQJTKOLPPAKRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19Cl2N3O/c19-15-8-6-13(10-16(15)20)23-18(24)17-9-7-14(11-21-17)22-12-4-2-1-3-5-12/h6-12,22H,1-5H2,(H,23,24).
What are the key properties of 5-(cyclohexylamino)-N-(3,4-dichlorophenyl)pyridine-2-carboxamide?
5-(cyclohexylamino)-N-(3,4-dichlorophenyl)pyridine-2-carboxamide has a molecular weight of 364.28 g/mol, XLogP of 5.39, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(cyclohexylamino)-N-(3,4-dichlorophenyl)pyridine-2-carboxamide is sourced from PubChem (CID 109183218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).