(1,2,2-trimethylcyclopentyl)methanol

C9H18O — CID 12003447

IUPAC(1,2,2-trimethylcyclopentyl)methanol
SMILESCC1(C)CCCC1(C)CO
InChIInChI=1S/C9H18O/c1-8(2)5-4-6-9(8,3)7-10/h10H,4-7H2,1-3H3
InChIKeyDZNAYDQTRXDOQM-UHFFFAOYSA-N
MW142.24 g/mol
LogP2.20
Rot. Bonds1

About (1,2,2-trimethylcyclopentyl)methanol

(1,2,2-trimethylcyclopentyl)methanol (PubChem CID 12003447) has the molecular formula C9H18O and a molecular weight of 142.24 g/mol. Its IUPAC name is (1,2,2-trimethylcyclopentyl)methanol.

Molecular Properties

Compound Name(1,2,2-trimethylcyclopentyl)methanol
PubChem CID12003447
Molecular FormulaC9H18O
Molecular Weight142.24 g/mol
Exact Mass142.14
IUPAC Name(1,2,2-trimethylcyclopentyl)methanol
SMILESCC1(C)CCCC1(C)CO
InChIInChI=1S/C9H18O/c1-8(2)5-4-6-9(8,3)7-10/h10H,4-7H2,1-3H3
InChIKeyDZNAYDQTRXDOQM-UHFFFAOYSA-N
XLogP2.20
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.24
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (1,2,2-trimethylcyclopentyl)methanol?
The IUPAC name of (1,2,2-trimethylcyclopentyl)methanol (CID 12003447) is (1,2,2-trimethylcyclopentyl)methanol.
What is the SMILES notation for (1,2,2-trimethylcyclopentyl)methanol?
The canonical SMILES for (1,2,2-trimethylcyclopentyl)methanol is CC1(C)CCCC1(C)CO.
What is the InChIKey of (1,2,2-trimethylcyclopentyl)methanol?
The InChIKey is DZNAYDQTRXDOQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18O/c1-8(2)5-4-6-9(8,3)7-10/h10H,4-7H2,1-3H3.
What are the key properties of (1,2,2-trimethylcyclopentyl)methanol?
(1,2,2-trimethylcyclopentyl)methanol has a molecular weight of 142.24 g/mol, XLogP of 2.20, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1,2,2-trimethylcyclopentyl)methanol is sourced from PubChem (CID 12003447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).