cis-(1S,5R)-2,2,5-trimethylcyclopentan-1-ol

C8H16O — CID 101036298

IUPACcis-(1S,5R)-2,2,5-trimethylcyclopentan-1-ol
SMILESC[C@@H]1CCC(C)(C)[C@H]1O
InChIInChI=1S/C8H16O/c1-6-4-5-8(2,3)7(6)9/h6-7,9H,4-5H2,1-3H3/t6-,7+/m1/s1
InChIKeyIVYCFOKDUKSLQF-RQJHMYQMSA-N
MW128.22 g/mol
LogP1.80
Rot. Bonds

About cis-(1S,5R)-2,2,5-trimethylcyclopentan-1-ol

cis-(1S,5R)-2,2,5-trimethylcyclopentan-1-ol (PubChem CID 101036298) has the molecular formula C8H16O and a molecular weight of 128.22 g/mol. Its IUPAC name is cis-(1S,5R)-2,2,5-trimethylcyclopentan-1-ol.

Molecular Properties

Compound Namecis-(1S,5R)-2,2,5-trimethylcyclopentan-1-ol
PubChem CID101036298
Molecular FormulaC8H16O
Molecular Weight128.22 g/mol
Exact Mass128.12
IUPAC Namecis-(1S,5R)-2,2,5-trimethylcyclopentan-1-ol
SMILESC[C@@H]1CCC(C)(C)[C@H]1O
InChIInChI=1S/C8H16O/c1-6-4-5-8(2,3)7(6)9/h6-7,9H,4-5H2,1-3H3/t6-,7+/m1/s1
InChIKeyIVYCFOKDUKSLQF-RQJHMYQMSA-N
XLogP1.80
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
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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Related Compounds

3,3-dimethylcyclopentane-1,2-diol
CID 22245615
2-hydroxy-1,3-dimethylcyclopentane-1-carboxylic acid
CID 130685696
5-(dimethylamino)-2,2-dimethylcyclopentan-1-ol
CID 79857600
(2S)-1,1,2-trimethylcyclobutane
CID 59954523
trans-(1S,5S)-5-(2-hydroxyethyl)-2,2-dimethylcyclopentan-1-ol
CID 131855256
2,2-dimethyl-5-(2-methylpyrrolidin-1-yl)cyclopentan-1-ol
CID 79857715
1,5,5,6-tetramethylcyclohexane-1,2-diol
CID 130145073
2,2-dimethyl-5-sulfanylcyclohexan-1-ol
CID 144679012
5-(1-hydroxy-2,2-dimethylpropyl)-2,2-dimethylcyclopentan-1-ol
CID 140608930
2,2-dimethylcyclohexan-1-ol
CID 557637
1,2,3-trimethylcyclopentan-1-ol
CID 23077337
[(1S,3R,4R)-1,3,4-trimethylcyclohexyl]methanol
CID 129322383

Frequently Asked Questions

What is the IUPAC name of cis-(1S,5R)-2,2,5-trimethylcyclopentan-1-ol?
The IUPAC name of cis-(1S,5R)-2,2,5-trimethylcyclopentan-1-ol (CID 101036298) is cis-(1S,5R)-2,2,5-trimethylcyclopentan-1-ol.
What is the SMILES notation for cis-(1S,5R)-2,2,5-trimethylcyclopentan-1-ol?
The canonical SMILES for cis-(1S,5R)-2,2,5-trimethylcyclopentan-1-ol is C[C@@H]1CCC(C)(C)[C@H]1O.
What is the InChIKey of cis-(1S,5R)-2,2,5-trimethylcyclopentan-1-ol?
The InChIKey is IVYCFOKDUKSLQF-RQJHMYQMSA-N. The full InChI is InChI=1S/C8H16O/c1-6-4-5-8(2,3)7(6)9/h6-7,9H,4-5H2,1-3H3/t6-,7+/m1/s1.
What are the key properties of cis-(1S,5R)-2,2,5-trimethylcyclopentan-1-ol?
cis-(1S,5R)-2,2,5-trimethylcyclopentan-1-ol has a molecular weight of 128.22 g/mol, XLogP of 1.80, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cis-(1S,5R)-2,2,5-trimethylcyclopentan-1-ol is sourced from PubChem (CID 101036298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).