N-(4-cyanophenyl)-5-(cyclohexylamino)pyridine-3-carboxamide

C19H20N4O — CID 109226990

IUPACN-(4-cyanophenyl)-5-(cyclohexylamino)pyridine-3-carboxamide
SMILESN#Cc1ccc(NC(=O)c2cncc(NC3CCCCC3)c2)cc1
InChIInChI=1S/C19H20N4O/c20-11-14-6-8-17(9-7-14)23-19(24)15-10-18(13-21-12-15)22-16-4-2-1-3-5-16/h6-10,12-13,16,22H,1-5H2,(H,23,24)
InChIKeyXHNBPHNEZNMJDC-UHFFFAOYSA-N
MW320.40 g/mol
LogP3.95
Rot. Bonds4

About N-(4-cyanophenyl)-5-(cyclohexylamino)pyridine-3-carboxamide

N-(4-cyanophenyl)-5-(cyclohexylamino)pyridine-3-carboxamide (PubChem CID 109226990) has the molecular formula C19H20N4O and a molecular weight of 320.40 g/mol. Its IUPAC name is N-(4-cyanophenyl)-5-(cyclohexylamino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(4-cyanophenyl)-5-(cyclohexylamino)pyridine-3-carboxamide
PubChem CID109226990
Molecular FormulaC19H20N4O
Molecular Weight320.40 g/mol
Exact Mass320.16
IUPAC NameN-(4-cyanophenyl)-5-(cyclohexylamino)pyridine-3-carboxamide
SMILESN#Cc1ccc(NC(=O)c2cncc(NC3CCCCC3)c2)cc1
InChIInChI=1S/C19H20N4O/c20-11-14-6-8-17(9-7-14)23-19(24)15-10-18(13-21-12-15)22-16-4-2-1-3-5-16/h6-10,12-13,16,22H,1-5H2,(H,23,24)
InChIKeyXHNBPHNEZNMJDC-UHFFFAOYSA-N
XLogP3.95
TPSA77.81 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.40
LogP ≤ 53.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-cyanophenyl)-5-(cyclohexylamino)pyridine-3-carboxamide
CID 109226989
N-(4-bromophenyl)-5-(cyclohexylamino)pyridine-3-carboxamide
CID 109226928
N-(4-cyanophenyl)-2-(cyclohexylamino)pyrimidine-5-carboxamide
CID 109250637
methyl 4-[[5-(cyclohexylamino)pyridine-3-carbonyl]amino]benzoate
CID 109226950
5-(cyclopentylamino)-N-[4-(dimethylamino)phenyl]pyridine-3-carboxamide
CID 109226211
N-(4-bromophenyl)-5-(cyclopropylamino)pyridine-3-carboxamide
CID 109223876
N-(3-bromophenyl)-5-(cyclohexylamino)pyridine-3-carboxamide
CID 109226964
N-(3-acetamidophenyl)-5-(cyclohexylamino)pyridine-3-carboxamide
CID 109226946
N-(3-acetylphenyl)-5-(cyclohexylamino)pyridine-3-carboxamide
CID 109226944
5-(cyclopentylamino)-N-(3,5-dichlorophenyl)pyridine-3-carboxamide
CID 109226240
5-(4-cyanoanilino)-N-(4-piperidin-1-ylphenyl)pyridine-3-carboxamide
CID 109246057
5-(cyclopentylamino)-N-cyclopropylpyridine-3-carboxamide
CID 109223558

Frequently Asked Questions

What is the IUPAC name of N-(4-cyanophenyl)-5-(cyclohexylamino)pyridine-3-carboxamide?
The IUPAC name of N-(4-cyanophenyl)-5-(cyclohexylamino)pyridine-3-carboxamide (CID 109226990) is N-(4-cyanophenyl)-5-(cyclohexylamino)pyridine-3-carboxamide.
What is the SMILES notation for N-(4-cyanophenyl)-5-(cyclohexylamino)pyridine-3-carboxamide?
The canonical SMILES for N-(4-cyanophenyl)-5-(cyclohexylamino)pyridine-3-carboxamide is N#Cc1ccc(NC(=O)c2cncc(NC3CCCCC3)c2)cc1.
What is the InChIKey of N-(4-cyanophenyl)-5-(cyclohexylamino)pyridine-3-carboxamide?
The InChIKey is XHNBPHNEZNMJDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O/c20-11-14-6-8-17(9-7-14)23-19(24)15-10-18(13-21-12-15)22-16-4-2-1-3-5-16/h6-10,12-13,16,22H,1-5H2,(H,23,24).
What are the key properties of N-(4-cyanophenyl)-5-(cyclohexylamino)pyridine-3-carboxamide?
N-(4-cyanophenyl)-5-(cyclohexylamino)pyridine-3-carboxamide has a molecular weight of 320.40 g/mol, XLogP of 3.95, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-cyanophenyl)-5-(cyclohexylamino)pyridine-3-carboxamide is sourced from PubChem (CID 109226990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).