N-[[2-(3-methylbutoxy)phenyl]methyl]-2-oxo-6-phenyl-1H-pyridine-3-carboxamide

C24H26N2O3 — CID 60622044

IUPACN-[[2-(3-methylbutoxy)phenyl]methyl]-2-oxo-6-phenyl-1H-pyridine-3-carboxamide
SMILESCC(C)CCOc1ccccc1CNC(=O)c1ccc(-c2ccccc2)[nH]c1=O
InChIInChI=1S/C24H26N2O3/c1-17(2)14-15-29-22-11-7-6-10-19(22)16-25-23(27)20-12-13-21(26-24(20)28)18-8-4-3-5-9-18/h3-13,17H,14-16H2,1-2H3,(H,25,27)(H,26,28)
InChIKeyRIHQXFHUIIVEFV-UHFFFAOYSA-N
MW390.48 g/mol
LogP4.40
Rot. Bonds8

About N-[[2-(3-methylbutoxy)phenyl]methyl]-2-oxo-6-phenyl-1H-pyridine-3-carboxamide

N-[[2-(3-methylbutoxy)phenyl]methyl]-2-oxo-6-phenyl-1H-pyridine-3-carboxamide (PubChem CID 60622044) has the molecular formula C24H26N2O3 and a molecular weight of 390.48 g/mol. Its IUPAC name is N-[[2-(3-methylbutoxy)phenyl]methyl]-2-oxo-6-phenyl-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[[2-(3-methylbutoxy)phenyl]methyl]-2-oxo-6-phenyl-1H-pyridine-3-carboxamide
PubChem CID60622044
Molecular FormulaC24H26N2O3
Molecular Weight390.48 g/mol
Exact Mass390.19
IUPAC NameN-[[2-(3-methylbutoxy)phenyl]methyl]-2-oxo-6-phenyl-1H-pyridine-3-carboxamide
SMILESCC(C)CCOc1ccccc1CNC(=O)c1ccc(-c2ccccc2)[nH]c1=O
InChIInChI=1S/C24H26N2O3/c1-17(2)14-15-29-22-11-7-6-10-19(22)16-25-23(27)20-12-13-21(26-24(20)28)18-8-4-3-5-9-18/h3-13,17H,14-16H2,1-2H3,(H,25,27)(H,26,28)
InChIKeyRIHQXFHUIIVEFV-UHFFFAOYSA-N
XLogP4.40
TPSA71.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.48
LogP ≤ 54.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[2-(3-methylbutoxy)phenyl]methyl]-2-propan-2-ylsulfonylbenzamide
CID 60622145
N-[[2-(3-methylbutoxy)phenyl]methyl]-2-morpholin-4-ylbenzamide
CID 60621982
N-[(4-hydroxy-3-methoxyphenyl)methyl]-2-oxo-6-phenyl-1H-pyridine-3-carboxamide
CID 60508987
N-[(3,4-dimethoxyphenyl)methyl]-2-oxo-6-(4-phenylphenyl)-1H-pyridine-3-carboxamide
CID 66497970
N-[(4-ethoxy-3-methoxyphenyl)methyl]-2-oxo-6-phenyl-1H-pyridine-3-carboxamide
CID 55762586
N-[[2-(3-methylbutoxy)phenyl]methyl]-2-phenylmethoxypropanamide
CID 60618262
2-(4-aminophenyl)-N-[[2-(3-methylbutoxy)phenyl]methyl]acetamide
CID 119759010
6-(4-fluorophenyl)-N-(2-methylpropyl)-2-oxo-1H-pyridine-3-carboxamide
CID 125491162
N-(2-cyanoethyl)-2-oxo-6-phenyl-1H-pyridine-3-carboxamide
CID 129350671
3-bromo-N-[[2-(3-methylbutoxy)phenyl]methyl]thiophene-2-carboxamide
CID 60618416
(2S)-2-amino-3,3-dimethyl-N-[[2-(3-methylbutoxy)phenyl]methyl]butanamide;hydrochloride
CID 119759025
N-benzyl-6-(3,4-dimethoxyphenyl)-2-oxo-1H-pyridine-3-carboxamide
CID 25096901

Frequently Asked Questions

What is the IUPAC name of N-[[2-(3-methylbutoxy)phenyl]methyl]-2-oxo-6-phenyl-1H-pyridine-3-carboxamide?
The IUPAC name of N-[[2-(3-methylbutoxy)phenyl]methyl]-2-oxo-6-phenyl-1H-pyridine-3-carboxamide (CID 60622044) is N-[[2-(3-methylbutoxy)phenyl]methyl]-2-oxo-6-phenyl-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-[[2-(3-methylbutoxy)phenyl]methyl]-2-oxo-6-phenyl-1H-pyridine-3-carboxamide?
The canonical SMILES for N-[[2-(3-methylbutoxy)phenyl]methyl]-2-oxo-6-phenyl-1H-pyridine-3-carboxamide is CC(C)CCOc1ccccc1CNC(=O)c1ccc(-c2ccccc2)[nH]c1=O.
What is the InChIKey of N-[[2-(3-methylbutoxy)phenyl]methyl]-2-oxo-6-phenyl-1H-pyridine-3-carboxamide?
The InChIKey is RIHQXFHUIIVEFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N2O3/c1-17(2)14-15-29-22-11-7-6-10-19(22)16-25-23(27)20-12-13-21(26-24(20)28)18-8-4-3-5-9-18/h3-13,17H,14-16H2,1-2H3,(H,25,27)(H,26,28).
What are the key properties of N-[[2-(3-methylbutoxy)phenyl]methyl]-2-oxo-6-phenyl-1H-pyridine-3-carboxamide?
N-[[2-(3-methylbutoxy)phenyl]methyl]-2-oxo-6-phenyl-1H-pyridine-3-carboxamide has a molecular weight of 390.48 g/mol, XLogP of 4.40, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(3-methylbutoxy)phenyl]methyl]-2-oxo-6-phenyl-1H-pyridine-3-carboxamide is sourced from PubChem (CID 60622044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).