3-(3-hydroxy-2,3-dimethylbutan-2-yl)-1,1-dimethylurea

C9H20N2O2 — CID 103933635

IUPAC3-(3-hydroxy-2,3-dimethylbutan-2-yl)-1,1-dimethylurea
SMILESCN(C)C(=O)NC(C)(C)C(C)(C)O
InChIInChI=1S/C9H20N2O2/c1-8(2,9(3,4)13)10-7(12)11(5)6/h13H,1-6H3,(H,10,12)
InChIKeyOYVCAYCRSGCRMF-UHFFFAOYSA-N
MW188.27 g/mol
LogP0.81
Rot. Bonds2

About 3-(3-hydroxy-2,3-dimethylbutan-2-yl)-1,1-dimethylurea

3-(3-hydroxy-2,3-dimethylbutan-2-yl)-1,1-dimethylurea (PubChem CID 103933635) has the molecular formula C9H20N2O2 and a molecular weight of 188.27 g/mol. Its IUPAC name is 3-(3-hydroxy-2,3-dimethylbutan-2-yl)-1,1-dimethylurea.

Molecular Properties

Compound Name3-(3-hydroxy-2,3-dimethylbutan-2-yl)-1,1-dimethylurea
PubChem CID103933635
Molecular FormulaC9H20N2O2
Molecular Weight188.27 g/mol
Exact Mass188.15
IUPAC Name3-(3-hydroxy-2,3-dimethylbutan-2-yl)-1,1-dimethylurea
SMILESCN(C)C(=O)NC(C)(C)C(C)(C)O
InChIInChI=1S/C9H20N2O2/c1-8(2,9(3,4)13)10-7(12)11(5)6/h13H,1-6H3,(H,10,12)
InChIKeyOYVCAYCRSGCRMF-UHFFFAOYSA-N
XLogP0.81
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.27
LogP ≤ 50.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1,1-dimethyl-3-(trifluoromethyl)urea
CID 174290727
1,1-dimethyl-3-(3-methylpentan-3-yl)urea
CID 103661863
2-bromo-N-(3-hydroxy-2,3-dimethylbutan-2-yl)-2-methylpropanamide
CID 106186134
4-N-(3-hydroxy-2,3-dimethylbutan-2-yl)-1-N,1-N-dimethylpiperidine-1,4-dicarboxamide
CID 103895580
N-(3-hydroxy-2,3-dimethylbutan-2-yl)pyrrolidine-1-carboxamide
CID 104594555
N-(3-hydroxy-2,3-dimethylbutan-2-yl)-2-methylcyclopropane-1-carboxamide
CID 103895464
3-[(dimethylcarbamoylamino)-diphenylmethyl]-1,1-dimethylurea
CID 146447985
N-(3-hydroxy-2,3-dimethylbutan-2-yl)-2-methyl-3-(methylamino)propanamide
CID 106188163
3-(1-amino-1-hydroxyimino-2-methylbutan-2-yl)-1,1-dimethylurea
CID 79154540
1,1-dimethyl-3-[2-[2-(trifluoromethyl)phenyl]propan-2-yl]urea
CID 110460027
N-(3-hydroxy-2,3-dimethylbutan-2-yl)-3-methylthiophene-2-carboxamide
CID 103895410
1,1-dimethyl-3-(2-thiophen-2-ylpropan-2-yl)urea
CID 110870551

Frequently Asked Questions

What is the IUPAC name of 3-(3-hydroxy-2,3-dimethylbutan-2-yl)-1,1-dimethylurea?
The IUPAC name of 3-(3-hydroxy-2,3-dimethylbutan-2-yl)-1,1-dimethylurea (CID 103933635) is 3-(3-hydroxy-2,3-dimethylbutan-2-yl)-1,1-dimethylurea.
What is the SMILES notation for 3-(3-hydroxy-2,3-dimethylbutan-2-yl)-1,1-dimethylurea?
The canonical SMILES for 3-(3-hydroxy-2,3-dimethylbutan-2-yl)-1,1-dimethylurea is CN(C)C(=O)NC(C)(C)C(C)(C)O.
What is the InChIKey of 3-(3-hydroxy-2,3-dimethylbutan-2-yl)-1,1-dimethylurea?
The InChIKey is OYVCAYCRSGCRMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O2/c1-8(2,9(3,4)13)10-7(12)11(5)6/h13H,1-6H3,(H,10,12).
What are the key properties of 3-(3-hydroxy-2,3-dimethylbutan-2-yl)-1,1-dimethylurea?
3-(3-hydroxy-2,3-dimethylbutan-2-yl)-1,1-dimethylurea has a molecular weight of 188.27 g/mol, XLogP of 0.81, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-hydroxy-2,3-dimethylbutan-2-yl)-1,1-dimethylurea is sourced from PubChem (CID 103933635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).