2-methyl-3-oxo-N-propyl-1,2-oxazole-5-carboxamide

C8H12N2O3 — CID 130688625

IUPAC2-methyl-3-oxo-N-propyl-1,2-oxazole-5-carboxamide
SMILESCCCNC(=O)c1cc(=O)n(C)o1
InChIInChI=1S/C8H12N2O3/c1-3-4-9-8(12)6-5-7(11)10(2)13-6/h5H,3-4H2,1-2H3,(H,9,12)
InChIKeyMQEUDUIBWVVNLR-UHFFFAOYSA-N
MW184.19 g/mol
LogP0.12
Rot. Bonds3

About 2-methyl-3-oxo-N-propyl-1,2-oxazole-5-carboxamide

2-methyl-3-oxo-N-propyl-1,2-oxazole-5-carboxamide (PubChem CID 130688625) has the molecular formula C8H12N2O3 and a molecular weight of 184.19 g/mol. Its IUPAC name is 2-methyl-3-oxo-N-propyl-1,2-oxazole-5-carboxamide.

Molecular Properties

Compound Name2-methyl-3-oxo-N-propyl-1,2-oxazole-5-carboxamide
PubChem CID130688625
Molecular FormulaC8H12N2O3
Molecular Weight184.19 g/mol
Exact Mass184.08
IUPAC Name2-methyl-3-oxo-N-propyl-1,2-oxazole-5-carboxamide
SMILESCCCNC(=O)c1cc(=O)n(C)o1
InChIInChI=1S/C8H12N2O3/c1-3-4-9-8(12)6-5-7(11)10(2)13-6/h5H,3-4H2,1-2H3,(H,9,12)
InChIKeyMQEUDUIBWVVNLR-UHFFFAOYSA-N
XLogP0.12
TPSA64.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.19
LogP ≤ 50.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-methyl-3-oxo-N-propyl-1,2-oxazole-5-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-(1-fluoropropan-2-yl)-3-oxo-1,2-oxazole-5-carboxamide
CID 130831795
N-(2-fluoroethyl)-3-oxo-1,2-oxazole-5-carboxamide
CID 131102028
3-oxo-N-propan-2-yl-1,2-oxazole-5-carboxamide
CID 574557
5-(Ethylaminomethyl)-1,2-oxazol-3-one
CID 13382965
N-Methyl-3-oxo-2,3-dihydroisoxazole-5-carboxamide
CID 45084178
N-((3-oxo-2,3-dihydroisoxazol-5-yl)methyl)acetamide
CID 45099133
N-(3-methylbutyl)-3-oxo-1,2-oxazole-5-carboxamide
CID 57766085
2-hydroxy-N-propylbut-2-enamide
CID 87228475
N-(2-methylpropyl)-3-oxo-1,2-oxazole-5-carboxamide
CID 127009007
N,N-dimethyl-3-oxo-1,2-oxazole-5-carboxamide
CID 131086233
N-cyclopropyl-3-oxo-1,2-oxazole-5-carboxamide
CID 131129718
N-[2-(dimethylamino)ethyl]-3-oxo-1,2-oxazole-5-carboxamide
CID 141996214

Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-oxo-N-propyl-1,2-oxazole-5-carboxamide?
The IUPAC name of 2-methyl-3-oxo-N-propyl-1,2-oxazole-5-carboxamide (CID 130688625) is 2-methyl-3-oxo-N-propyl-1,2-oxazole-5-carboxamide.
What is the SMILES notation for 2-methyl-3-oxo-N-propyl-1,2-oxazole-5-carboxamide?
The canonical SMILES for 2-methyl-3-oxo-N-propyl-1,2-oxazole-5-carboxamide is CCCNC(=O)c1cc(=O)n(C)o1.
What is the InChIKey of 2-methyl-3-oxo-N-propyl-1,2-oxazole-5-carboxamide?
The InChIKey is MQEUDUIBWVVNLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2O3/c1-3-4-9-8(12)6-5-7(11)10(2)13-6/h5H,3-4H2,1-2H3,(H,9,12).
What are the key properties of 2-methyl-3-oxo-N-propyl-1,2-oxazole-5-carboxamide?
2-methyl-3-oxo-N-propyl-1,2-oxazole-5-carboxamide has a molecular weight of 184.19 g/mol, XLogP of 0.12, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-oxo-N-propyl-1,2-oxazole-5-carboxamide is sourced from PubChem (CID 130688625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).