N-(3-acetamidophenyl)-5-(cyclohexylamino)pyridine-3-carboxamide

C20H24N4O2 — CID 109226946

IUPACN-(3-acetamidophenyl)-5-(cyclohexylamino)pyridine-3-carboxamide
SMILESCC(=O)Nc1cccc(NC(=O)c2cncc(NC3CCCCC3)c2)c1
InChIInChI=1S/C20H24N4O2/c1-14(25)22-17-8-5-9-18(11-17)24-20(26)15-10-19(13-21-12-15)23-16-6-3-2-4-7-16/h5,8-13,16,23H,2-4,6-7H2,1H3,(H,22,25)(H,24,26)
InChIKeyLPLYZIDTIMNWNA-UHFFFAOYSA-N
MW352.44 g/mol
LogP4.04
Rot. Bonds5

About N-(3-acetamidophenyl)-5-(cyclohexylamino)pyridine-3-carboxamide

N-(3-acetamidophenyl)-5-(cyclohexylamino)pyridine-3-carboxamide (PubChem CID 109226946) has the molecular formula C20H24N4O2 and a molecular weight of 352.44 g/mol. Its IUPAC name is N-(3-acetamidophenyl)-5-(cyclohexylamino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(3-acetamidophenyl)-5-(cyclohexylamino)pyridine-3-carboxamide
PubChem CID109226946
Molecular FormulaC20H24N4O2
Molecular Weight352.44 g/mol
Exact Mass352.19
IUPAC NameN-(3-acetamidophenyl)-5-(cyclohexylamino)pyridine-3-carboxamide
SMILESCC(=O)Nc1cccc(NC(=O)c2cncc(NC3CCCCC3)c2)c1
InChIInChI=1S/C20H24N4O2/c1-14(25)22-17-8-5-9-18(11-17)24-20(26)15-10-19(13-21-12-15)23-16-6-3-2-4-7-16/h5,8-13,16,23H,2-4,6-7H2,1H3,(H,22,25)(H,24,26)
InChIKeyLPLYZIDTIMNWNA-UHFFFAOYSA-N
XLogP4.04
TPSA83.12 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.44
LogP ≤ 54.04
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-acetylphenyl)-5-(cyclohexylamino)pyridine-3-carboxamide
CID 109226944
N-(3-bromophenyl)-5-(cyclohexylamino)pyridine-3-carboxamide
CID 109226964
5-(cycloheptylamino)-N-(3-methoxyphenyl)pyridine-3-carboxamide
CID 109239626
N-(3-cyanophenyl)-5-(cyclohexylamino)pyridine-3-carboxamide
CID 109226989
N-(4-bromophenyl)-5-(cyclohexylamino)pyridine-3-carboxamide
CID 109226928
methyl 4-[[5-(cyclohexylamino)pyridine-3-carbonyl]amino]benzoate
CID 109226950
5-(cyclopentylamino)-N-[4-(dimethylamino)phenyl]pyridine-3-carboxamide
CID 109226211
N-(4-cyanophenyl)-5-(cyclohexylamino)pyridine-3-carboxamide
CID 109226990
5-(cyclopentylamino)-N-(3,5-dichlorophenyl)pyridine-3-carboxamide
CID 109226240
5-(cycloheptylamino)-N-propan-2-ylpyridine-3-carboxamide
CID 109223234
N-(2-chlorophenyl)-5-(cyclopentylamino)pyridine-3-carboxamide
CID 109226175
5-(cyclopentylamino)-N-cyclopropylpyridine-3-carboxamide
CID 109223558

Frequently Asked Questions

What is the IUPAC name of N-(3-acetamidophenyl)-5-(cyclohexylamino)pyridine-3-carboxamide?
The IUPAC name of N-(3-acetamidophenyl)-5-(cyclohexylamino)pyridine-3-carboxamide (CID 109226946) is N-(3-acetamidophenyl)-5-(cyclohexylamino)pyridine-3-carboxamide.
What is the SMILES notation for N-(3-acetamidophenyl)-5-(cyclohexylamino)pyridine-3-carboxamide?
The canonical SMILES for N-(3-acetamidophenyl)-5-(cyclohexylamino)pyridine-3-carboxamide is CC(=O)Nc1cccc(NC(=O)c2cncc(NC3CCCCC3)c2)c1.
What is the InChIKey of N-(3-acetamidophenyl)-5-(cyclohexylamino)pyridine-3-carboxamide?
The InChIKey is LPLYZIDTIMNWNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N4O2/c1-14(25)22-17-8-5-9-18(11-17)24-20(26)15-10-19(13-21-12-15)23-16-6-3-2-4-7-16/h5,8-13,16,23H,2-4,6-7H2,1H3,(H,22,25)(H,24,26).
What are the key properties of N-(3-acetamidophenyl)-5-(cyclohexylamino)pyridine-3-carboxamide?
N-(3-acetamidophenyl)-5-(cyclohexylamino)pyridine-3-carboxamide has a molecular weight of 352.44 g/mol, XLogP of 4.04, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetamidophenyl)-5-(cyclohexylamino)pyridine-3-carboxamide is sourced from PubChem (CID 109226946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).