(1,2-dimethylcyclopropyl)methanol

C6H12O — CID 19437298

IUPAC(1,2-dimethylcyclopropyl)methanol
SMILESCC1CC1(C)CO
InChIInChI=1S/C6H12O/c1-5-3-6(5,2)4-7/h5,7H,3-4H2,1-2H3
InChIKeyLVUZRABOZYCSGQ-UHFFFAOYSA-N
MW100.16 g/mol
LogP1.02
Rot. Bonds1

About (1,2-dimethylcyclopropyl)methanol

(1,2-dimethylcyclopropyl)methanol (PubChem CID 19437298) has the molecular formula C6H12O and a molecular weight of 100.16 g/mol. Its IUPAC name is (1,2-dimethylcyclopropyl)methanol.

Molecular Properties

Compound Name(1,2-dimethylcyclopropyl)methanol
PubChem CID19437298
Molecular FormulaC6H12O
Molecular Weight100.16 g/mol
Exact Mass100.09
IUPAC Name(1,2-dimethylcyclopropyl)methanol
SMILESCC1CC1(C)CO
InChIInChI=1S/C6H12O/c1-5-3-6(5,2)4-7/h5,7H,3-4H2,1-2H3
InChIKeyLVUZRABOZYCSGQ-UHFFFAOYSA-N
XLogP1.02
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500100.16
LogP ≤ 51.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze (1,2-dimethylcyclopropyl)methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (1,2-dimethylcyclopropyl)methanol?
The IUPAC name of (1,2-dimethylcyclopropyl)methanol (CID 19437298) is (1,2-dimethylcyclopropyl)methanol.
What is the SMILES notation for (1,2-dimethylcyclopropyl)methanol?
The canonical SMILES for (1,2-dimethylcyclopropyl)methanol is CC1CC1(C)CO.
What is the InChIKey of (1,2-dimethylcyclopropyl)methanol?
The InChIKey is LVUZRABOZYCSGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12O/c1-5-3-6(5,2)4-7/h5,7H,3-4H2,1-2H3.
What are the key properties of (1,2-dimethylcyclopropyl)methanol?
(1,2-dimethylcyclopropyl)methanol has a molecular weight of 100.16 g/mol, XLogP of 1.02, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1,2-dimethylcyclopropyl)methanol is sourced from PubChem (CID 19437298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).