N-(2-amino-2-oxoethyl)-N-(2-methylpropyl)-4-oxo-1H-pyridine-3-carboxamide

C12H17N3O3 — CID 103337094

IUPACN-(2-amino-2-oxoethyl)-N-(2-methylpropyl)-4-oxo-1H-pyridine-3-carboxamide
SMILESCC(C)CN(CC(N)=O)C(=O)c1c[nH]ccc1=O
InChIInChI=1S/C12H17N3O3/c1-8(2)6-15(7-11(13)17)12(18)9-5-14-4-3-10(9)16/h3-5,8H,6-7H2,1-2H3,(H2,13,17)(H,14,16)
InChIKeySYOLJPJIVSKDDP-UHFFFAOYSA-N
MW251.29 g/mol
LogP-0.04
Rot. Bonds5

About N-(2-amino-2-oxoethyl)-N-(2-methylpropyl)-4-oxo-1H-pyridine-3-carboxamide

N-(2-amino-2-oxoethyl)-N-(2-methylpropyl)-4-oxo-1H-pyridine-3-carboxamide (PubChem CID 103337094) has the molecular formula C12H17N3O3 and a molecular weight of 251.29 g/mol. Its IUPAC name is N-(2-amino-2-oxoethyl)-N-(2-methylpropyl)-4-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2-amino-2-oxoethyl)-N-(2-methylpropyl)-4-oxo-1H-pyridine-3-carboxamide
PubChem CID103337094
Molecular FormulaC12H17N3O3
Molecular Weight251.29 g/mol
Exact Mass251.13
IUPAC NameN-(2-amino-2-oxoethyl)-N-(2-methylpropyl)-4-oxo-1H-pyridine-3-carboxamide
SMILESCC(C)CN(CC(N)=O)C(=O)c1c[nH]ccc1=O
InChIInChI=1S/C12H17N3O3/c1-8(2)6-15(7-11(13)17)12(18)9-5-14-4-3-10(9)16/h3-5,8H,6-7H2,1-2H3,(H2,13,17)(H,14,16)
InChIKeySYOLJPJIVSKDDP-UHFFFAOYSA-N
XLogP-0.04
TPSA96.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.29
LogP ≤ 5-0.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(2-amino-2-oxoethyl)-N-(2-methylpropyl)-4-oxo-1H-pyridine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2-amino-2-oxoethyl)-4-hydroxy-2-methyl-N-(2-methylpropyl)benzamide
CID 103865180
2-amino-N-(2-amino-2-oxoethyl)-5-fluoro-N-(2-methylpropyl)benzamide
CID 60962629
N-(2-amino-2-oxoethyl)-5-bromo-2-fluoro-N-(2-methylpropyl)benzamide
CID 60732695
N-benzyl-N-ethyl-4-oxo-1H-pyridine-3-carboxamide
CID 103337000
4-amino-N-(2-amino-2-oxoethyl)-1-methyl-N-(2-methylpropyl)pyrrole-2-carboxamide
CID 61110497
5-amino-N-(2-amino-2-oxoethyl)-2,4-difluoro-N-(2-methylpropyl)benzamide
CID 61109173
N-(2-amino-2-oxoethyl)-N-(2-methylpropyl)furan-2-carboxamide
CID 62734384
N-(2-amino-2-oxoethyl)-N-(2-methylpropyl)-1,2,3,4-tetrahydroquinoline-5-carboxamide
CID 62849738
5-amino-N-(2-amino-2-oxoethyl)-2-methyl-N-(2-methylpropyl)pyridine-3-carboxamide
CID 61108035
N-(2-amino-2-oxoethyl)-3-chloro-N-(2-methylpropyl)-2-nitrobenzamide
CID 115541100
N-(2-amino-2-oxoethyl)-N-(2-methylpropyl)-2,3-dihydro-1H-isoindole-5-carboxamide
CID 103998556
4-amino-N-(2-amino-2-oxoethyl)-N-(2-methylpropyl)-1H-pyrazole-5-carboxamide
CID 63104484

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-oxoethyl)-N-(2-methylpropyl)-4-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of N-(2-amino-2-oxoethyl)-N-(2-methylpropyl)-4-oxo-1H-pyridine-3-carboxamide (CID 103337094) is N-(2-amino-2-oxoethyl)-N-(2-methylpropyl)-4-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-(2-amino-2-oxoethyl)-N-(2-methylpropyl)-4-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for N-(2-amino-2-oxoethyl)-N-(2-methylpropyl)-4-oxo-1H-pyridine-3-carboxamide is CC(C)CN(CC(N)=O)C(=O)c1c[nH]ccc1=O.
What is the InChIKey of N-(2-amino-2-oxoethyl)-N-(2-methylpropyl)-4-oxo-1H-pyridine-3-carboxamide?
The InChIKey is SYOLJPJIVSKDDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N3O3/c1-8(2)6-15(7-11(13)17)12(18)9-5-14-4-3-10(9)16/h3-5,8H,6-7H2,1-2H3,(H2,13,17)(H,14,16).
What are the key properties of N-(2-amino-2-oxoethyl)-N-(2-methylpropyl)-4-oxo-1H-pyridine-3-carboxamide?
N-(2-amino-2-oxoethyl)-N-(2-methylpropyl)-4-oxo-1H-pyridine-3-carboxamide has a molecular weight of 251.29 g/mol, XLogP of -0.04, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-oxoethyl)-N-(2-methylpropyl)-4-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 103337094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).