N-carbamoyl-2-(1-cyclopropylimidazol-2-yl)sulfanylpropanamide

C10H14N4O2S — CID 46696360

IUPACN-carbamoyl-2-(1-cyclopropylimidazol-2-yl)sulfanylpropanamide
SMILESCC(Sc1nccn1C1CC1)C(=O)NC(N)=O
InChIInChI=1S/C10H14N4O2S/c1-6(8(15)13-9(11)16)17-10-12-4-5-14(10)7-2-3-7/h4-7H,2-3H2,1H3,(H3,11,13,15,16)
InChIKeyHZNAUWYXXPCJEG-UHFFFAOYSA-N
MW254.31 g/mol
LogP0.89
Rot. Bonds4

About N-carbamoyl-2-(1-cyclopropylimidazol-2-yl)sulfanylpropanamide

N-carbamoyl-2-(1-cyclopropylimidazol-2-yl)sulfanylpropanamide (PubChem CID 46696360) has the molecular formula C10H14N4O2S and a molecular weight of 254.31 g/mol. Its IUPAC name is N-carbamoyl-2-(1-cyclopropylimidazol-2-yl)sulfanylpropanamide.

Molecular Properties

Compound NameN-carbamoyl-2-(1-cyclopropylimidazol-2-yl)sulfanylpropanamide
PubChem CID46696360
Molecular FormulaC10H14N4O2S
Molecular Weight254.31 g/mol
Exact Mass254.08
IUPAC NameN-carbamoyl-2-(1-cyclopropylimidazol-2-yl)sulfanylpropanamide
SMILESCC(Sc1nccn1C1CC1)C(=O)NC(N)=O
InChIInChI=1S/C10H14N4O2S/c1-6(8(15)13-9(11)16)17-10-12-4-5-14(10)7-2-3-7/h4-7H,2-3H2,1H3,(H3,11,13,15,16)
InChIKeyHZNAUWYXXPCJEG-UHFFFAOYSA-N
XLogP0.89
TPSA90.01 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.31
LogP ≤ 50.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-carbamoyl-2-(1-cyclopropylimidazol-2-yl)sulfanylpropanamide 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-cyclopentyl-2-(1-methylimidazol-2-yl)sulfanylacetamide
CID 6460530
N-cyclohexyl-2-[(1-methyl-1H-imidazol-2-yl)sulfanyl]acetamide
CID 2997769
N-cyclopropyl-2-[(1-methyl-1H-imidazol-2-yl)sulfanyl]acetamide
CID 4178854
2-[(1-methyl-1H-imidazol-2-yl)sulfanyl]-N-(6-methyl-7-oxo-7H-[1,3]thiazolo[3,2-b][1,2,4]triazin-3-yl)acetamide
CID 42536800
N-cyclopropyl-2-(1H-imidazol-2-ylsulfanyl)-N-methylacetamide
CID 71995545
N-tert-butyl-2-[(1-methyl-1H-imidazol-2-yl)sulfanyl]acetamide
CID 15944404
2-(1-cyclopropylimidazol-2-yl)sulfanyl-N-ethylacetamide
CID 43038477
2-(2-methylsulfanylimidazol-1-yl)-N-propylacetamide
CID 75519951
N~2~-acetyl-N~1~-[2-(2-methyl-1H-imidazol-1-yl)ethyl]-L-methioninamide
CID 90653187
3-(1-Methylimidazol-2-yl)sulfanylpiperidine-2,6-dione
CID 142623396
2-(1-methylimidazol-2-yl)sulfanyl-N-(2,2,2-trifluoroethylcarbamoyl)acetamide
CID 17395774
2-(1-cyclopropylimidazol-2-yl)sulfanyl-N-(2,2,2-trifluoroethylcarbamoyl)acetamide
CID 25416725

Frequently Asked Questions

What is the IUPAC name of N-carbamoyl-2-(1-cyclopropylimidazol-2-yl)sulfanylpropanamide?
The IUPAC name of N-carbamoyl-2-(1-cyclopropylimidazol-2-yl)sulfanylpropanamide (CID 46696360) is N-carbamoyl-2-(1-cyclopropylimidazol-2-yl)sulfanylpropanamide.
What is the SMILES notation for N-carbamoyl-2-(1-cyclopropylimidazol-2-yl)sulfanylpropanamide?
The canonical SMILES for N-carbamoyl-2-(1-cyclopropylimidazol-2-yl)sulfanylpropanamide is CC(Sc1nccn1C1CC1)C(=O)NC(N)=O.
What is the InChIKey of N-carbamoyl-2-(1-cyclopropylimidazol-2-yl)sulfanylpropanamide?
The InChIKey is HZNAUWYXXPCJEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4O2S/c1-6(8(15)13-9(11)16)17-10-12-4-5-14(10)7-2-3-7/h4-7H,2-3H2,1H3,(H3,11,13,15,16).
What are the key properties of N-carbamoyl-2-(1-cyclopropylimidazol-2-yl)sulfanylpropanamide?
N-carbamoyl-2-(1-cyclopropylimidazol-2-yl)sulfanylpropanamide has a molecular weight of 254.31 g/mol, XLogP of 0.89, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-carbamoyl-2-(1-cyclopropylimidazol-2-yl)sulfanylpropanamide is sourced from PubChem (CID 46696360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).