3-cyclobutyl-1-(3-hydroxybutyl)-1-methylurea

C10H20N2O2 — CID 115735319

IUPAC3-cyclobutyl-1-(3-hydroxybutyl)-1-methylurea
SMILESCC(O)CCN(C)C(=O)NC1CCC1
InChIInChI=1S/C10H20N2O2/c1-8(13)6-7-12(2)10(14)11-9-4-3-5-9/h8-9,13H,3-7H2,1-2H3,(H,11,14)
InChIKeyLCAVHINIUINPKG-UHFFFAOYSA-N
MW200.28 g/mol
LogP0.95
Rot. Bonds4

About 3-cyclobutyl-1-(3-hydroxybutyl)-1-methylurea

3-cyclobutyl-1-(3-hydroxybutyl)-1-methylurea (PubChem CID 115735319) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is 3-cyclobutyl-1-(3-hydroxybutyl)-1-methylurea.

Molecular Properties

Compound Name3-cyclobutyl-1-(3-hydroxybutyl)-1-methylurea
PubChem CID115735319
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC Name3-cyclobutyl-1-(3-hydroxybutyl)-1-methylurea
SMILESCC(O)CCN(C)C(=O)NC1CCC1
InChIInChI=1S/C10H20N2O2/c1-8(13)6-7-12(2)10(14)11-9-4-3-5-9/h8-9,13H,3-7H2,1-2H3,(H,11,14)
InChIKeyLCAVHINIUINPKG-UHFFFAOYSA-N
XLogP0.95
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 50.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 3-cyclobutyl-1-(3-hydroxybutyl)-1-methylurea 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

3-cyclobutyl-1-methyl-1-(3-methylbutyl)urea
CID 115617736
1-(3-aminobutyl)-3-cyclobutyl-1-methylurea
CID 116658911
3-cyclobutyl-1-[2-(dimethylamino)ethyl]-1-methylurea
CID 115672508
1-(2-aminoethyl)-3-cyclobutyl-1-methylurea
CID 82503265
N-cyclohexyl-2-[3-hydroxybutyl(methyl)amino]propanamide
CID 111496931
3-cyclobutyl-1-methyl-1-(2-methylbutyl)urea
CID 115621990
1-(3-amino-3-sulfanylidenepropyl)-3-cyclobutyl-1-methylurea
CID 116658284
3-[(3S)-1-(2-fluoro-5-methylphenyl)piperidin-3-yl]-1-[(3R)-3-hydroxybutyl]-1-methylurea
CID 97069908
3-cyclobutyl-1-cyclopentyl-1-(3-methylbutyl)urea
CID 115642218
3-cyclohexyl-1-methyl-1-(2-methylbutyl)urea
CID 115585875
3-cyclopentyl-1-(cyclopentylmethyl)-1-methylurea
CID 115597933
3-cyclobutyl-1-hydroxy-1-methylurea
CID 130900785

Frequently Asked Questions

What is the IUPAC name of 3-cyclobutyl-1-(3-hydroxybutyl)-1-methylurea?
The IUPAC name of 3-cyclobutyl-1-(3-hydroxybutyl)-1-methylurea (CID 115735319) is 3-cyclobutyl-1-(3-hydroxybutyl)-1-methylurea.
What is the SMILES notation for 3-cyclobutyl-1-(3-hydroxybutyl)-1-methylurea?
The canonical SMILES for 3-cyclobutyl-1-(3-hydroxybutyl)-1-methylurea is CC(O)CCN(C)C(=O)NC1CCC1.
What is the InChIKey of 3-cyclobutyl-1-(3-hydroxybutyl)-1-methylurea?
The InChIKey is LCAVHINIUINPKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2/c1-8(13)6-7-12(2)10(14)11-9-4-3-5-9/h8-9,13H,3-7H2,1-2H3,(H,11,14).
What are the key properties of 3-cyclobutyl-1-(3-hydroxybutyl)-1-methylurea?
3-cyclobutyl-1-(3-hydroxybutyl)-1-methylurea has a molecular weight of 200.28 g/mol, XLogP of 0.95, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclobutyl-1-(3-hydroxybutyl)-1-methylurea is sourced from PubChem (CID 115735319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).