1-(1,3-oxazol-2-yl)-3-[(1R)-1-(1,3-thiazol-2-yl)propyl]urea

C10H12N4O2S — CID 97307926

IUPAC1-(1,3-oxazol-2-yl)-3-[(1R)-1-(1,3-thiazol-2-yl)propyl]urea
SMILESCC[C@@H](NC(=O)Nc1ncco1)c1nccs1
InChIInChI=1S/C10H12N4O2S/c1-2-7(8-11-4-6-17-8)13-9(15)14-10-12-3-5-16-10/h3-7H,2H2,1H3,(H2,12,13,14,15)/t7-/m1/s1
InChIKeyYRCCWCHMROXUSA-SSDOTTSWSA-N
MW252.30 g/mol
LogP2.40
Rot. Bonds4

About 1-(1,3-oxazol-2-yl)-3-[(1R)-1-(1,3-thiazol-2-yl)propyl]urea

1-(1,3-oxazol-2-yl)-3-[(1R)-1-(1,3-thiazol-2-yl)propyl]urea (PubChem CID 97307926) has the molecular formula C10H12N4O2S and a molecular weight of 252.30 g/mol. Its IUPAC name is 1-(1,3-oxazol-2-yl)-3-[(1R)-1-(1,3-thiazol-2-yl)propyl]urea.

Molecular Properties

Compound Name1-(1,3-oxazol-2-yl)-3-[(1R)-1-(1,3-thiazol-2-yl)propyl]urea
PubChem CID97307926
Molecular FormulaC10H12N4O2S
Molecular Weight252.30 g/mol
Exact Mass252.07
IUPAC Name1-(1,3-oxazol-2-yl)-3-[(1R)-1-(1,3-thiazol-2-yl)propyl]urea
SMILESCC[C@@H](NC(=O)Nc1ncco1)c1nccs1
InChIInChI=1S/C10H12N4O2S/c1-2-7(8-11-4-6-17-8)13-9(15)14-10-12-3-5-16-10/h3-7H,2H2,1H3,(H2,12,13,14,15)/t7-/m1/s1
InChIKeyYRCCWCHMROXUSA-SSDOTTSWSA-N
XLogP2.40
TPSA80.05 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.30
LogP ≤ 52.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 1-(1,3-oxazol-2-yl)-3-[(1R)-1-(1,3-thiazol-2-yl)propyl]urea 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

(2R)-3,3-dimethyl-2-[1-(1,3-thiazol-2-yl)propylcarbamoylamino]butanoic acid
CID 103928082
(2R)-2-amino-N-[1-(1,3-thiazol-2-yl)propyl]pentanamide
CID 103814744
4-[1-(1,3-thiazol-2-yl)propylcarbamoylamino]oxolane-3-carboxylic acid
CID 66240579
1-(2-cyclohexylpyrazol-3-yl)-3-[1-(1,3-thiazol-2-yl)propyl]urea
CID 56794173
2-[1-(1,3-thiazol-2-yl)propylcarbamoylamino]cyclopentane-1-carboxylic acid
CID 64815807
2,2-dimethyl-3-oxo-3-[1-(1,3-thiazol-2-yl)propylamino]propanoic acid
CID 82821210
tert-butyl N-[1-(1,3-thiazol-2-yl)propyl]carbamate
CID 64688740
2-(aminomethyl)-4,4-dimethyl-N-[1-(1,3-thiazol-2-yl)propyl]pentanamide
CID 107472241
2-amino-3-phenyl-N-[1-(1,3-thiazol-2-yl)propyl]propanamide;dihydrochloride
CID 119890751
2-methyl-N-[1-(1,3-thiazol-2-yl)propyl]pyrrolidine-3-carboxamide
CID 79384523
N-[1-(1,3-thiazol-2-yl)propyl]piperidine-1-carboxamide
CID 115642007
2-(4-sulfanylphenyl)-N-[1-(1,3-thiazol-2-yl)propyl]acetamide
CID 107030803

Frequently Asked Questions

What is the IUPAC name of 1-(1,3-oxazol-2-yl)-3-[(1R)-1-(1,3-thiazol-2-yl)propyl]urea?
The IUPAC name of 1-(1,3-oxazol-2-yl)-3-[(1R)-1-(1,3-thiazol-2-yl)propyl]urea (CID 97307926) is 1-(1,3-oxazol-2-yl)-3-[(1R)-1-(1,3-thiazol-2-yl)propyl]urea.
What is the SMILES notation for 1-(1,3-oxazol-2-yl)-3-[(1R)-1-(1,3-thiazol-2-yl)propyl]urea?
The canonical SMILES for 1-(1,3-oxazol-2-yl)-3-[(1R)-1-(1,3-thiazol-2-yl)propyl]urea is CC[C@@H](NC(=O)Nc1ncco1)c1nccs1.
What is the InChIKey of 1-(1,3-oxazol-2-yl)-3-[(1R)-1-(1,3-thiazol-2-yl)propyl]urea?
The InChIKey is YRCCWCHMROXUSA-SSDOTTSWSA-N. The full InChI is InChI=1S/C10H12N4O2S/c1-2-7(8-11-4-6-17-8)13-9(15)14-10-12-3-5-16-10/h3-7H,2H2,1H3,(H2,12,13,14,15)/t7-/m1/s1.
What are the key properties of 1-(1,3-oxazol-2-yl)-3-[(1R)-1-(1,3-thiazol-2-yl)propyl]urea?
1-(1,3-oxazol-2-yl)-3-[(1R)-1-(1,3-thiazol-2-yl)propyl]urea has a molecular weight of 252.30 g/mol, XLogP of 2.40, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,3-oxazol-2-yl)-3-[(1R)-1-(1,3-thiazol-2-yl)propyl]urea is sourced from PubChem (CID 97307926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).