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

C20H23N3O2 — CID 109226944

IUPACN-(3-acetylphenyl)-5-(cyclohexylamino)pyridine-3-carboxamide
SMILESCC(=O)c1cccc(NC(=O)c2cncc(NC3CCCCC3)c2)c1
InChIInChI=1S/C20H23N3O2/c1-14(24)15-6-5-9-18(10-15)23-20(25)16-11-19(13-21-12-16)22-17-7-3-2-4-8-17/h5-6,9-13,17,22H,2-4,7-8H2,1H3,(H,23,25)
InChIKeyUZFQTDRTCWSVFQ-UHFFFAOYSA-N
MW337.42 g/mol
LogP4.28
Rot. Bonds5

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

N-(3-acetylphenyl)-5-(cyclohexylamino)pyridine-3-carboxamide (PubChem CID 109226944) has the molecular formula C20H23N3O2 and a molecular weight of 337.42 g/mol. Its IUPAC name is N-(3-acetylphenyl)-5-(cyclohexylamino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(3-acetylphenyl)-5-(cyclohexylamino)pyridine-3-carboxamide
PubChem CID109226944
Molecular FormulaC20H23N3O2
Molecular Weight337.42 g/mol
Exact Mass337.18
IUPAC NameN-(3-acetylphenyl)-5-(cyclohexylamino)pyridine-3-carboxamide
SMILESCC(=O)c1cccc(NC(=O)c2cncc(NC3CCCCC3)c2)c1
InChIInChI=1S/C20H23N3O2/c1-14(24)15-6-5-9-18(10-15)23-20(25)16-11-19(13-21-12-16)22-17-7-3-2-4-8-17/h5-6,9-13,17,22H,2-4,7-8H2,1H3,(H,23,25)
InChIKeyUZFQTDRTCWSVFQ-UHFFFAOYSA-N
XLogP4.28
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.42
LogP ≤ 54.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-acetamidophenyl)-5-(cyclohexylamino)pyridine-3-carboxamide
CID 109226946
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
N-(3-acetylphenyl)-4-(cyclopentylamino)pyridine-2-carboxamide
CID 109204307
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
1-N-(3-acetylphenyl)-3-N-cyclopentylbenzene-1,3-dicarboxamide
CID 109051927

Frequently Asked Questions

What is the IUPAC name of N-(3-acetylphenyl)-5-(cyclohexylamino)pyridine-3-carboxamide?
The IUPAC name of N-(3-acetylphenyl)-5-(cyclohexylamino)pyridine-3-carboxamide (CID 109226944) is N-(3-acetylphenyl)-5-(cyclohexylamino)pyridine-3-carboxamide.
What is the SMILES notation for N-(3-acetylphenyl)-5-(cyclohexylamino)pyridine-3-carboxamide?
The canonical SMILES for N-(3-acetylphenyl)-5-(cyclohexylamino)pyridine-3-carboxamide is CC(=O)c1cccc(NC(=O)c2cncc(NC3CCCCC3)c2)c1.
What is the InChIKey of N-(3-acetylphenyl)-5-(cyclohexylamino)pyridine-3-carboxamide?
The InChIKey is UZFQTDRTCWSVFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3O2/c1-14(24)15-6-5-9-18(10-15)23-20(25)16-11-19(13-21-12-16)22-17-7-3-2-4-8-17/h5-6,9-13,17,22H,2-4,7-8H2,1H3,(H,23,25).
What are the key properties of N-(3-acetylphenyl)-5-(cyclohexylamino)pyridine-3-carboxamide?
N-(3-acetylphenyl)-5-(cyclohexylamino)pyridine-3-carboxamide has a molecular weight of 337.42 g/mol, XLogP of 4.28, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetylphenyl)-5-(cyclohexylamino)pyridine-3-carboxamide is sourced from PubChem (CID 109226944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).