(5E)-5-ethylidene-2,2-dimethylcyclopentan-1-ol

C9H16O — CID 10374541

IUPAC(5E)-5-ethylidene-2,2-dimethylcyclopentan-1-ol
SMILESC/C=C1\CCC(C)(C)C1O
InChIInChI=1S/C9H16O/c1-4-7-5-6-9(2,3)8(7)10/h4,8,10H,5-6H2,1-3H3/b7-4+
InChIKeyQIIZQNABBJKVJS-QPJJXVBHSA-N
MW140.23 g/mol
LogP2.11
Rot. Bonds

About (5E)-5-ethylidene-2,2-dimethylcyclopentan-1-ol

(5E)-5-ethylidene-2,2-dimethylcyclopentan-1-ol (PubChem CID 10374541) has the molecular formula C9H16O and a molecular weight of 140.23 g/mol. Its IUPAC name is (5E)-5-ethylidene-2,2-dimethylcyclopentan-1-ol.

Molecular Properties

Compound Name(5E)-5-ethylidene-2,2-dimethylcyclopentan-1-ol
PubChem CID10374541
Molecular FormulaC9H16O
Molecular Weight140.23 g/mol
Exact Mass140.12
IUPAC Name(5E)-5-ethylidene-2,2-dimethylcyclopentan-1-ol
SMILESC/C=C1\CCC(C)(C)C1O
InChIInChI=1S/C9H16O/c1-4-7-5-6-9(2,3)8(7)10/h4,8,10H,5-6H2,1-3H3/b7-4+
InChIKeyQIIZQNABBJKVJS-QPJJXVBHSA-N
XLogP2.11
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.23
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

Isophorol
CID 79016
4-Hexen-3-ol, 4-methyl-6-(2,2,3-trimethyl-3-cyclopenten-1-yl)-
CID 106812
3,6,6-Trimethyl-cyclohex-2-enol
CID 558613
3-Methyl-5-(2,2,3-trimethyl-3-cyclopenten-1-yl)-3-penten-2-ol
CID 6437460
Isophorol, (-)-
CID 6999727
2,6,6-Trimethyl-2-cyclohexen-1-ol
CID 536364
Cyclopentanol, 2-[2-(2,2,3-trimethyl-3-cyclopenten-1-yl)ethylidene]-
CID 70585872
Isophorol, (+)-
CID 6992208
2-(2-(2,2,3-Trimethyl-3-cyclopenten-1-yl)ethylidene)pentan-1-ol
CID 6365762
(1R,4R)-4-tert-butylcyclopent-2-en-1-ol
CID 13915300
3,4,4-Trimethylcyclopent-2-en-1-ol
CID 46944495
3-Methyl-5-(2,2,3-trimethylcyclopent-3-en-1-yl)pent-3-en-2-ol
CID 109411

Frequently Asked Questions

What is the IUPAC name of (5E)-5-ethylidene-2,2-dimethylcyclopentan-1-ol?
The IUPAC name of (5E)-5-ethylidene-2,2-dimethylcyclopentan-1-ol (CID 10374541) is (5E)-5-ethylidene-2,2-dimethylcyclopentan-1-ol.
What is the SMILES notation for (5E)-5-ethylidene-2,2-dimethylcyclopentan-1-ol?
The canonical SMILES for (5E)-5-ethylidene-2,2-dimethylcyclopentan-1-ol is C/C=C1\CCC(C)(C)C1O.
What is the InChIKey of (5E)-5-ethylidene-2,2-dimethylcyclopentan-1-ol?
The InChIKey is QIIZQNABBJKVJS-QPJJXVBHSA-N. The full InChI is InChI=1S/C9H16O/c1-4-7-5-6-9(2,3)8(7)10/h4,8,10H,5-6H2,1-3H3/b7-4+.
What are the key properties of (5E)-5-ethylidene-2,2-dimethylcyclopentan-1-ol?
(5E)-5-ethylidene-2,2-dimethylcyclopentan-1-ol has a molecular weight of 140.23 g/mol, XLogP of 2.11, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (5E)-5-ethylidene-2,2-dimethylcyclopentan-1-ol is sourced from PubChem (CID 10374541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).