2-(2-oxo-1H-imidazol-3-yl)-N-propylacetamide

C8H13N3O2 — CID 103125250

IUPAC2-(2-oxo-1H-imidazol-3-yl)-N-propylacetamide
SMILESCCCNC(=O)Cn1cc[nH]c1=O
InChIInChI=1S/C8H13N3O2/c1-2-3-9-7(12)6-11-5-4-10-8(11)13/h4-5H,2-3,6H2,1H3,(H,9,12)(H,10,13)
InChIKeyOJTNLPPDCGMNLI-UHFFFAOYSA-N
MW183.21 g/mol
LogP-0.30
Rot. Bonds4

About 2-(2-oxo-1H-imidazol-3-yl)-N-propylacetamide

2-(2-oxo-1H-imidazol-3-yl)-N-propylacetamide (PubChem CID 103125250) has the molecular formula C8H13N3O2 and a molecular weight of 183.21 g/mol. Its IUPAC name is 2-(2-oxo-1H-imidazol-3-yl)-N-propylacetamide.

Molecular Properties

Compound Name2-(2-oxo-1H-imidazol-3-yl)-N-propylacetamide
PubChem CID103125250
Molecular FormulaC8H13N3O2
Molecular Weight183.21 g/mol
Exact Mass183.10
IUPAC Name2-(2-oxo-1H-imidazol-3-yl)-N-propylacetamide
SMILESCCCNC(=O)Cn1cc[nH]c1=O
InChIInChI=1S/C8H13N3O2/c1-2-3-9-7(12)6-11-5-4-10-8(11)13/h4-5H,2-3,6H2,1H3,(H,9,12)(H,10,13)
InChIKeyOJTNLPPDCGMNLI-UHFFFAOYSA-N
XLogP-0.30
TPSA66.89 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.21
LogP ≤ 5-0.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-acetyl-N-ethyl-2,3-dihydropyrazine-1-carboxamide
CID 146035530
2-(3-ethyl-2-oxoimidazol-1-yl)-N-(2,2,2-trifluoroethyl)acetamide
CID 116624349
2-(3-methyl-2-oxoimidazol-1-yl)-N-(2,2,2-trifluoroethyl)acetamide
CID 116624583
2-(2-oxo-3-propylimidazol-1-yl)-N-(2,2,2-trifluoroethyl)acetamide
CID 116624874
2-(2-oxo-3-propan-2-ylimidazol-1-yl)-N-(2,2,2-trifluoroethyl)acetamide
CID 116625166
2-(diethylamino)-N-[(3-methyl-2H-imidazol-1-yl)methyl]acetamide
CID 57165918
2-Methylidene-1,3,8,11-tetrazacyclopentadecane-9,10-dione
CID 67125118
N-butyl-N-methyl-2-(1-methyl-1,2-dihydroimidazol-1-ium-3-yl)acetamide bromide
CID 67523463
N,N-diethyl-2-(1-methyl-1,2-dihydroimidazol-1-ium-3-yl)acetamide bromide
CID 67523534
N-butyl-2-(1-methyl-1,2-dihydroimidazol-1-ium-3-yl)acetamide bromide
CID 69670276
N-[1-acetamido-2-[acetyl(ethenyl)amino]ethyl]acetamide
CID 87622573
N-[3-(3-methyl-2H-imidazol-1-yl)propyl]acetamide
CID 89269343

Frequently Asked Questions

What is the IUPAC name of 2-(2-oxo-1H-imidazol-3-yl)-N-propylacetamide?
The IUPAC name of 2-(2-oxo-1H-imidazol-3-yl)-N-propylacetamide (CID 103125250) is 2-(2-oxo-1H-imidazol-3-yl)-N-propylacetamide.
What is the SMILES notation for 2-(2-oxo-1H-imidazol-3-yl)-N-propylacetamide?
The canonical SMILES for 2-(2-oxo-1H-imidazol-3-yl)-N-propylacetamide is CCCNC(=O)Cn1cc[nH]c1=O.
What is the InChIKey of 2-(2-oxo-1H-imidazol-3-yl)-N-propylacetamide?
The InChIKey is OJTNLPPDCGMNLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3O2/c1-2-3-9-7(12)6-11-5-4-10-8(11)13/h4-5H,2-3,6H2,1H3,(H,9,12)(H,10,13).
What are the key properties of 2-(2-oxo-1H-imidazol-3-yl)-N-propylacetamide?
2-(2-oxo-1H-imidazol-3-yl)-N-propylacetamide has a molecular weight of 183.21 g/mol, XLogP of -0.30, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-oxo-1H-imidazol-3-yl)-N-propylacetamide is sourced from PubChem (CID 103125250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).