1,1-dimethyl-3-(2-thiophen-2-ylpropan-2-yl)urea

C10H16N2OS — CID 110870551

IUPAC1,1-dimethyl-3-(2-thiophen-2-ylpropan-2-yl)urea
SMILESCN(C)C(=O)NC(C)(C)c1cccs1
InChIInChI=1S/C10H16N2OS/c1-10(2,8-6-5-7-14-8)11-9(13)12(3)4/h5-7H,1-4H3,(H,11,13)
InChIKeyHYHKSNBMYQOCBI-UHFFFAOYSA-N
MW212.32 g/mol
LogP2.25
Rot. Bonds2

About 1,1-dimethyl-3-(2-thiophen-2-ylpropan-2-yl)urea

1,1-dimethyl-3-(2-thiophen-2-ylpropan-2-yl)urea (PubChem CID 110870551) has the molecular formula C10H16N2OS and a molecular weight of 212.32 g/mol. Its IUPAC name is 1,1-dimethyl-3-(2-thiophen-2-ylpropan-2-yl)urea.

Molecular Properties

Compound Name1,1-dimethyl-3-(2-thiophen-2-ylpropan-2-yl)urea
PubChem CID110870551
Molecular FormulaC10H16N2OS
Molecular Weight212.32 g/mol
Exact Mass212.10
IUPAC Name1,1-dimethyl-3-(2-thiophen-2-ylpropan-2-yl)urea
SMILESCN(C)C(=O)NC(C)(C)c1cccs1
InChIInChI=1S/C10H16N2OS/c1-10(2,8-6-5-7-14-8)11-9(13)12(3)4/h5-7H,1-4H3,(H,11,13)
InChIKeyHYHKSNBMYQOCBI-UHFFFAOYSA-N
XLogP2.25
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.32
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1,1-dimethyl-3-(2-thiophen-2-ylpropan-2-yl)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

1,1-diethyl-3-(2-thiophen-2-ylpropan-2-yl)urea
CID 110870552
(2S)-2-amino-N-(2-thiophen-2-ylpropan-2-yl)propanamide
CID 119325779
2-amino-N-(2-thiophen-2-ylpropan-2-yl)propanamide;hydrochloride
CID 119325781
(2S)-2-amino-N-(2-thiophen-2-ylpropan-2-yl)butanamide
CID 119325785
2-(4-fluorophenyl)-N-(2-thiophen-2-ylpropan-2-yl)acetamide
CID 110870545
2-methyl-2-thiophen-2-ylpropanoic acid;hydrochloride
CID 67842906
3-(4-ethylpiperazin-1-yl)-N-(2-thiophen-2-ylpropan-2-yl)propanamide
CID 71866753
1-hydroxy-1,1-dithiophen-2-ylpropan-2-one
CID 23553455
N-propan-2-yl-2-thiophen-2-ylpropan-2-amine
CID 130725780
1-ethyl-1-methyl-3-(2-methyl-2-thiophen-2-ylpropyl)urea
CID 115627643
1,1-dimethyl-3-[2-[2-(trifluoromethyl)phenyl]propan-2-yl]urea
CID 110460027
3-cyano-N-(2-thiophen-2-ylpropan-2-yl)benzamide
CID 110870539

Frequently Asked Questions

What is the IUPAC name of 1,1-dimethyl-3-(2-thiophen-2-ylpropan-2-yl)urea?
The IUPAC name of 1,1-dimethyl-3-(2-thiophen-2-ylpropan-2-yl)urea (CID 110870551) is 1,1-dimethyl-3-(2-thiophen-2-ylpropan-2-yl)urea.
What is the SMILES notation for 1,1-dimethyl-3-(2-thiophen-2-ylpropan-2-yl)urea?
The canonical SMILES for 1,1-dimethyl-3-(2-thiophen-2-ylpropan-2-yl)urea is CN(C)C(=O)NC(C)(C)c1cccs1.
What is the InChIKey of 1,1-dimethyl-3-(2-thiophen-2-ylpropan-2-yl)urea?
The InChIKey is HYHKSNBMYQOCBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2OS/c1-10(2,8-6-5-7-14-8)11-9(13)12(3)4/h5-7H,1-4H3,(H,11,13).
What are the key properties of 1,1-dimethyl-3-(2-thiophen-2-ylpropan-2-yl)urea?
1,1-dimethyl-3-(2-thiophen-2-ylpropan-2-yl)urea has a molecular weight of 212.32 g/mol, XLogP of 2.25, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-dimethyl-3-(2-thiophen-2-ylpropan-2-yl)urea is sourced from PubChem (CID 110870551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).