1-[2-(dimethylamino)-2-oxoethyl]-N-methyl-2-oxo-N-(2-phenylpropyl)pyridine-3-carboxamide

C20H25N3O3 — CID 110246860

IUPAC1-[2-(dimethylamino)-2-oxoethyl]-N-methyl-2-oxo-N-(2-phenylpropyl)pyridine-3-carboxamide
SMILESCC(CN(C)C(=O)c1cccn(CC(=O)N(C)C)c1=O)c1ccccc1
InChIInChI=1S/C20H25N3O3/c1-15(16-9-6-5-7-10-16)13-22(4)19(25)17-11-8-12-23(20(17)26)14-18(24)21(2)3/h5-12,15H,13-14H2,1-4H3
InChIKeyWVIZTFNHBIZEMG-UHFFFAOYSA-N
MW355.44 g/mol
LogP1.81
Rot. Bonds6

About 1-[2-(dimethylamino)-2-oxoethyl]-N-methyl-2-oxo-N-(2-phenylpropyl)pyridine-3-carboxamide

1-[2-(dimethylamino)-2-oxoethyl]-N-methyl-2-oxo-N-(2-phenylpropyl)pyridine-3-carboxamide (PubChem CID 110246860) has the molecular formula C20H25N3O3 and a molecular weight of 355.44 g/mol. Its IUPAC name is 1-[2-(dimethylamino)-2-oxoethyl]-N-methyl-2-oxo-N-(2-phenylpropyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name1-[2-(dimethylamino)-2-oxoethyl]-N-methyl-2-oxo-N-(2-phenylpropyl)pyridine-3-carboxamide
PubChem CID110246860
Molecular FormulaC20H25N3O3
Molecular Weight355.44 g/mol
Exact Mass355.19
IUPAC Name1-[2-(dimethylamino)-2-oxoethyl]-N-methyl-2-oxo-N-(2-phenylpropyl)pyridine-3-carboxamide
SMILESCC(CN(C)C(=O)c1cccn(CC(=O)N(C)C)c1=O)c1ccccc1
InChIInChI=1S/C20H25N3O3/c1-15(16-9-6-5-7-10-16)13-22(4)19(25)17-11-8-12-23(20(17)26)14-18(24)21(2)3/h5-12,15H,13-14H2,1-4H3
InChIKeyWVIZTFNHBIZEMG-UHFFFAOYSA-N
XLogP1.81
TPSA62.62 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.44
LogP ≤ 51.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)-N-[(2R)-2-phenylpropyl]pyridine-3-carboxamide
CID 92635837
1-[2-(cyclohexylamino)-2-oxoethyl]-N-methyl-2-oxo-N-[(2R)-2-phenylpropyl]pyridine-3-carboxamide
CID 92635828
1-[2-(dimethylamino)-2-oxoethyl]-N-methyl-2-oxo-N-(quinolin-6-ylmethyl)pyridine-3-carboxamide
CID 92635136
5-[methyl-[(2S)-2-phenylpropyl]carbamoyl]furan-2-carboxylic acid
CID 99851700
N,N-dimethyl-2-propan-2-ylbenzamide;1-ethyl-3-propan-2-ylpyridin-2-one
CID 177347775
N-methyl-N-(2-phenylpropyl)but-3-enamide
CID 143446604
2-[2-(2-methylbenzoyl)pyrrol-1-yl]-N-(2-phenylpropyl)acetamide
CID 20889292
4-bromo-N-methyl-N-[(2S)-2-phenylpropyl]-1H-pyrazole-5-carboxamide
CID 96516992
N-(2-hydroxypropyl)-N-methyl-2-sulfanylbenzamide
CID 107028256
N-methyl-2-(methylsulfamoyl)-N-(2-phenylpropyl)acetamide
CID 71974926
1-ethyl-1-methyl-3-[(2S)-2-phenylpropyl]urea
CID 97028200
N-methyl-2-(2-oxo-1-pyridinyl)-N-propan-2-ylacetamide
CID 115577760

Frequently Asked Questions

What is the IUPAC name of 1-[2-(dimethylamino)-2-oxoethyl]-N-methyl-2-oxo-N-(2-phenylpropyl)pyridine-3-carboxamide?
The IUPAC name of 1-[2-(dimethylamino)-2-oxoethyl]-N-methyl-2-oxo-N-(2-phenylpropyl)pyridine-3-carboxamide (CID 110246860) is 1-[2-(dimethylamino)-2-oxoethyl]-N-methyl-2-oxo-N-(2-phenylpropyl)pyridine-3-carboxamide.
What is the SMILES notation for 1-[2-(dimethylamino)-2-oxoethyl]-N-methyl-2-oxo-N-(2-phenylpropyl)pyridine-3-carboxamide?
The canonical SMILES for 1-[2-(dimethylamino)-2-oxoethyl]-N-methyl-2-oxo-N-(2-phenylpropyl)pyridine-3-carboxamide is CC(CN(C)C(=O)c1cccn(CC(=O)N(C)C)c1=O)c1ccccc1.
What is the InChIKey of 1-[2-(dimethylamino)-2-oxoethyl]-N-methyl-2-oxo-N-(2-phenylpropyl)pyridine-3-carboxamide?
The InChIKey is WVIZTFNHBIZEMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O3/c1-15(16-9-6-5-7-10-16)13-22(4)19(25)17-11-8-12-23(20(17)26)14-18(24)21(2)3/h5-12,15H,13-14H2,1-4H3.
What are the key properties of 1-[2-(dimethylamino)-2-oxoethyl]-N-methyl-2-oxo-N-(2-phenylpropyl)pyridine-3-carboxamide?
1-[2-(dimethylamino)-2-oxoethyl]-N-methyl-2-oxo-N-(2-phenylpropyl)pyridine-3-carboxamide has a molecular weight of 355.44 g/mol, XLogP of 1.81, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(dimethylamino)-2-oxoethyl]-N-methyl-2-oxo-N-(2-phenylpropyl)pyridine-3-carboxamide is sourced from PubChem (CID 110246860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).