1-cyclohexyl-N-[(3,4-dichlorophenyl)methyl]-4-hydroxy-6-oxopyridine-3-carboxamide

C19H20Cl2N2O3 — CID 67104932

IUPAC1-cyclohexyl-N-[(3,4-dichlorophenyl)methyl]-4-hydroxy-6-oxopyridine-3-carboxamide
SMILESO=C(NCc1ccc(Cl)c(Cl)c1)c1cn(C2CCCCC2)c(=O)cc1O
InChIInChI=1S/C19H20Cl2N2O3/c20-15-7-6-12(8-16(15)21)10-22-19(26)14-11-23(18(25)9-17(14)24)13-4-2-1-3-5-13/h6-9,11,13,24H,1-5,10H2,(H,22,26)
InChIKeyAXXZQTIPVHHNMH-UHFFFAOYSA-N
MW395.29 g/mol
LogP4.30
Rot. Bonds4

About 1-cyclohexyl-N-[(3,4-dichlorophenyl)methyl]-4-hydroxy-6-oxopyridine-3-carboxamide

1-cyclohexyl-N-[(3,4-dichlorophenyl)methyl]-4-hydroxy-6-oxopyridine-3-carboxamide (PubChem CID 67104932) has the molecular formula C19H20Cl2N2O3 and a molecular weight of 395.29 g/mol. Its IUPAC name is 1-cyclohexyl-N-[(3,4-dichlorophenyl)methyl]-4-hydroxy-6-oxopyridine-3-carboxamide.

Molecular Properties

Compound Name1-cyclohexyl-N-[(3,4-dichlorophenyl)methyl]-4-hydroxy-6-oxopyridine-3-carboxamide
PubChem CID67104932
Molecular FormulaC19H20Cl2N2O3
Molecular Weight395.29 g/mol
Exact Mass394.09
IUPAC Name1-cyclohexyl-N-[(3,4-dichlorophenyl)methyl]-4-hydroxy-6-oxopyridine-3-carboxamide
SMILESO=C(NCc1ccc(Cl)c(Cl)c1)c1cn(C2CCCCC2)c(=O)cc1O
InChIInChI=1S/C19H20Cl2N2O3/c20-15-7-6-12(8-16(15)21)10-22-19(26)14-11-23(18(25)9-17(14)24)13-4-2-1-3-5-13/h6-9,11,13,24H,1-5,10H2,(H,22,26)
InChIKeyAXXZQTIPVHHNMH-UHFFFAOYSA-N
XLogP4.30
TPSA71.33 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.29
LogP ≤ 54.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-(cyclohexanecarbonyl)-N-[(3,4-dichlorophenyl)methyl]piperazine-1-carbothioamide
CID 3754161
N-[(4-chlorophenyl)methyl]-1-cyclopropyl-6-methyl-4-oxoquinoline-3-carboxamide;ethane
CID 142006209
N-cyclohexyl-2-(3,4-dichlorophenyl)acetamide
CID 2557208
N-[(3-chloro-4-fluorophenyl)methyl]-1-cyclohexylimidazol-2-amine
CID 106570228
N-[(3,4-dichlorophenyl)methyl]-6-hydroxy-5-oxo-2-(pyrrolidin-1-ylmethyl)-[1,3]thiazolo[3,2-a]pyrimidine-7-carboxamide
CID 59392900
N-[(4-bromophenyl)methyl]-4-chloro-1-cyclopropylpyrrole-2-carboxamide
CID 61401000
N-[(3,4-dichlorophenyl)methyl]cyclooctanamine;hydrochloride
CID 17331622
N-[(3,4-dichlorophenyl)methyl]-1H-imidazole-5-carboxamide
CID 141124421
1-cyclobutyl-N-[(4-hydroxyphenyl)methyl]pyrrole-2-carboxamide
CID 114609401
2-chloro-N-[(3,4-dichlorophenyl)methyl]acetamide
CID 3460813
5-chloro-N-[(4-cyclohexyl-1,2,4-triazol-3-yl)methyl]-2-oxo-1H-pyridine-3-carboxamide
CID 90653950
N-[[3-(azepan-1-ylmethyl)phenyl]methyl]-1-[(3,4-dichlorophenyl)methyl]piperidine-3-carboxamide
CID 43917450

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-N-[(3,4-dichlorophenyl)methyl]-4-hydroxy-6-oxopyridine-3-carboxamide?
The IUPAC name of 1-cyclohexyl-N-[(3,4-dichlorophenyl)methyl]-4-hydroxy-6-oxopyridine-3-carboxamide (CID 67104932) is 1-cyclohexyl-N-[(3,4-dichlorophenyl)methyl]-4-hydroxy-6-oxopyridine-3-carboxamide.
What is the SMILES notation for 1-cyclohexyl-N-[(3,4-dichlorophenyl)methyl]-4-hydroxy-6-oxopyridine-3-carboxamide?
The canonical SMILES for 1-cyclohexyl-N-[(3,4-dichlorophenyl)methyl]-4-hydroxy-6-oxopyridine-3-carboxamide is O=C(NCc1ccc(Cl)c(Cl)c1)c1cn(C2CCCCC2)c(=O)cc1O.
What is the InChIKey of 1-cyclohexyl-N-[(3,4-dichlorophenyl)methyl]-4-hydroxy-6-oxopyridine-3-carboxamide?
The InChIKey is AXXZQTIPVHHNMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20Cl2N2O3/c20-15-7-6-12(8-16(15)21)10-22-19(26)14-11-23(18(25)9-17(14)24)13-4-2-1-3-5-13/h6-9,11,13,24H,1-5,10H2,(H,22,26).
What are the key properties of 1-cyclohexyl-N-[(3,4-dichlorophenyl)methyl]-4-hydroxy-6-oxopyridine-3-carboxamide?
1-cyclohexyl-N-[(3,4-dichlorophenyl)methyl]-4-hydroxy-6-oxopyridine-3-carboxamide has a molecular weight of 395.29 g/mol, XLogP of 4.30, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-N-[(3,4-dichlorophenyl)methyl]-4-hydroxy-6-oxopyridine-3-carboxamide is sourced from PubChem (CID 67104932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).