(1,2-dimethylcyclopentyl)methanol

C8H16O — CID 544196

IUPAC(1,2-dimethylcyclopentyl)methanol
SMILESCC1CCCC1(C)CO
InChIInChI=1S/C8H16O/c1-7-4-3-5-8(7,2)6-9/h7,9H,3-6H2,1-2H3
InChIKeyAGOIDKSUUFYHSG-UHFFFAOYSA-N
MW128.22 g/mol
LogP1.80
Rot. Bonds1

About (1,2-dimethylcyclopentyl)methanol

(1,2-dimethylcyclopentyl)methanol (PubChem CID 544196) has the molecular formula C8H16O and a molecular weight of 128.22 g/mol. Its IUPAC name is (1,2-dimethylcyclopentyl)methanol.

Molecular Properties

Compound Name(1,2-dimethylcyclopentyl)methanol
PubChem CID544196
Molecular FormulaC8H16O
Molecular Weight128.22 g/mol
Exact Mass128.12
IUPAC Name(1,2-dimethylcyclopentyl)methanol
SMILESCC1CCCC1(C)CO
InChIInChI=1S/C8H16O/c1-7-4-3-5-8(7,2)6-9/h7,9H,3-6H2,1-2H3
InChIKeyAGOIDKSUUFYHSG-UHFFFAOYSA-N
XLogP1.80
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.22
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (1,2-dimethylcyclopentyl)methanol?
The IUPAC name of (1,2-dimethylcyclopentyl)methanol (CID 544196) is (1,2-dimethylcyclopentyl)methanol.
What is the SMILES notation for (1,2-dimethylcyclopentyl)methanol?
The canonical SMILES for (1,2-dimethylcyclopentyl)methanol is CC1CCCC1(C)CO.
What is the InChIKey of (1,2-dimethylcyclopentyl)methanol?
The InChIKey is AGOIDKSUUFYHSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16O/c1-7-4-3-5-8(7,2)6-9/h7,9H,3-6H2,1-2H3.
What are the key properties of (1,2-dimethylcyclopentyl)methanol?
(1,2-dimethylcyclopentyl)methanol has a molecular weight of 128.22 g/mol, XLogP of 1.80, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1,2-dimethylcyclopentyl)methanol is sourced from PubChem (CID 544196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).