1-(oxolan-2-yl)-3-(2-propan-2-ylphenyl)urea

C14H20N2O2 — CID 110706700

IUPAC1-(oxolan-2-yl)-3-(2-propan-2-ylphenyl)urea
SMILESCC(C)c1ccccc1NC(=O)NC1CCCO1
InChIInChI=1S/C14H20N2O2/c1-10(2)11-6-3-4-7-12(11)15-14(17)16-13-8-5-9-18-13/h3-4,6-7,10,13H,5,8-9H2,1-2H3,(H2,15,16,17)
InChIKeyDXXZQJDVKWRVJG-UHFFFAOYSA-N
MW248.33 g/mol
LogP3.07
Rot. Bonds3

About 1-(oxolan-2-yl)-3-(2-propan-2-ylphenyl)urea

1-(oxolan-2-yl)-3-(2-propan-2-ylphenyl)urea (PubChem CID 110706700) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is 1-(oxolan-2-yl)-3-(2-propan-2-ylphenyl)urea.

Molecular Properties

Compound Name1-(oxolan-2-yl)-3-(2-propan-2-ylphenyl)urea
PubChem CID110706700
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC Name1-(oxolan-2-yl)-3-(2-propan-2-ylphenyl)urea
SMILESCC(C)c1ccccc1NC(=O)NC1CCCO1
InChIInChI=1S/C14H20N2O2/c1-10(2)11-6-3-4-7-12(11)15-14(17)16-13-8-5-9-18-13/h3-4,6-7,10,13H,5,8-9H2,1-2H3,(H2,15,16,17)
InChIKeyDXXZQJDVKWRVJG-UHFFFAOYSA-N
XLogP3.07
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 53.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 1-(oxolan-2-yl)-3-(2-propan-2-ylphenyl)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

(2S)-N-(2-propan-2-ylphenyl)oxolane-2-carboxamide
CID 40532664
1-naphthalen-1-yl-3-(oxolan-2-yl)urea
CID 108887867
1-(3-methylcyclohexyl)-3-(2-propan-2-ylphenyl)urea
CID 47032083
1-[[5-[(2R)-oxolan-2-yl]-1,2,4-oxadiazol-3-yl]methyl]-3-(2-propan-2-ylphenyl)urea
CID 125167789
N-[2-oxo-2-(2-propan-2-ylanilino)ethyl]oxolane-2-carboxamide
CID 112997084
butyl 2-(oxolan-2-ylcarbamoylamino)benzoate
CID 108887818
2,2-dimethyl-N-(oxolan-2-ylmethyl)-N'-(2-propan-2-ylphenyl)propanediamide
CID 108960081
1-(3-methylphenyl)-3-(oxolan-2-yl)urea
CID 110706685
(2R)-2-(azocan-1-yl)-N-(2-propan-2-ylphenyl)propanamide
CID 9460394
1-(2,3-dimethylphenyl)-3-(2-propan-2-ylphenyl)urea
CID 108991425
4-N-propan-2-yl-1-N-(2-propan-2-ylphenyl)cyclohexane-1,4-dicarboxamide
CID 109144556
N-(2-propan-2-ylphenyl)morpholine-4-carboxamide
CID 3684146

Frequently Asked Questions

What is the IUPAC name of 1-(oxolan-2-yl)-3-(2-propan-2-ylphenyl)urea?
The IUPAC name of 1-(oxolan-2-yl)-3-(2-propan-2-ylphenyl)urea (CID 110706700) is 1-(oxolan-2-yl)-3-(2-propan-2-ylphenyl)urea.
What is the SMILES notation for 1-(oxolan-2-yl)-3-(2-propan-2-ylphenyl)urea?
The canonical SMILES for 1-(oxolan-2-yl)-3-(2-propan-2-ylphenyl)urea is CC(C)c1ccccc1NC(=O)NC1CCCO1.
What is the InChIKey of 1-(oxolan-2-yl)-3-(2-propan-2-ylphenyl)urea?
The InChIKey is DXXZQJDVKWRVJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2/c1-10(2)11-6-3-4-7-12(11)15-14(17)16-13-8-5-9-18-13/h3-4,6-7,10,13H,5,8-9H2,1-2H3,(H2,15,16,17).
What are the key properties of 1-(oxolan-2-yl)-3-(2-propan-2-ylphenyl)urea?
1-(oxolan-2-yl)-3-(2-propan-2-ylphenyl)urea has a molecular weight of 248.33 g/mol, XLogP of 3.07, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(oxolan-2-yl)-3-(2-propan-2-ylphenyl)urea is sourced from PubChem (CID 110706700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).