(2E)-4,4-dimethyl-2-(2-methylpropylidene)cyclopentan-1-ol

C11H20O — CID 10012301

IUPAC(2E)-4,4-dimethyl-2-(2-methylpropylidene)cyclopentan-1-ol
SMILESCC(C)/C=C1\CC(C)(C)CC1O
InChIInChI=1S/C11H20O/c1-8(2)5-9-6-11(3,4)7-10(9)12/h5,8,10,12H,6-7H2,1-4H3/b9-5+
InChIKeyYKDXKFYYJVBWAJ-WEVVVXLNSA-N
MW168.28 g/mol
LogP2.75
Rot. Bonds1

About (2E)-4,4-dimethyl-2-(2-methylpropylidene)cyclopentan-1-ol

(2E)-4,4-dimethyl-2-(2-methylpropylidene)cyclopentan-1-ol (PubChem CID 10012301) has the molecular formula C11H20O and a molecular weight of 168.28 g/mol. Its IUPAC name is (2E)-4,4-dimethyl-2-(2-methylpropylidene)cyclopentan-1-ol.

Molecular Properties

Compound Name(2E)-4,4-dimethyl-2-(2-methylpropylidene)cyclopentan-1-ol
PubChem CID10012301
Molecular FormulaC11H20O
Molecular Weight168.28 g/mol
Exact Mass168.15
IUPAC Name(2E)-4,4-dimethyl-2-(2-methylpropylidene)cyclopentan-1-ol
SMILESCC(C)/C=C1\CC(C)(C)CC1O
InChIInChI=1S/C11H20O/c1-8(2)5-9-6-11(3,4)7-10(9)12/h5,8,10,12H,6-7H2,1-4H3/b9-5+
InChIKeyYKDXKFYYJVBWAJ-WEVVVXLNSA-N
XLogP2.75
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.28
LogP ≤ 52.75
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

Carveol
CID 7438
Carveol, trans-(-)-
CID 94221
Carveol, cis-(-)-
CID 330573
(+)-cis-Carveol
CID 443177
Isophorol
CID 79016
(+)-trans-Carveol
CID 443178
(2E)-2-Methyl-4-(2,2,3-trimethyl-3-cyclopenten-1-yl)-2-buten-1-ol
CID 6438195
2-Ethyl-4-(2,2,3-trimethylcyclopent-3-en-1-yl)but-2-en-1-ol, (E)-
CID 6438196
3-Buten-2-ol, 3-methyl-4-[2,6,6-trimethyl-2-cyclohexen-1-yl]-
CID 5370103
Vetivenol
CID 3085365
2-Buten-1-ol, 2-methyl-4-(2,2,3-trimethyl-3-cyclopenten-1-yl)-
CID 119897
Isopalominol
CID 23427741

Frequently Asked Questions

What is the IUPAC name of (2E)-4,4-dimethyl-2-(2-methylpropylidene)cyclopentan-1-ol?
The IUPAC name of (2E)-4,4-dimethyl-2-(2-methylpropylidene)cyclopentan-1-ol (CID 10012301) is (2E)-4,4-dimethyl-2-(2-methylpropylidene)cyclopentan-1-ol.
What is the SMILES notation for (2E)-4,4-dimethyl-2-(2-methylpropylidene)cyclopentan-1-ol?
The canonical SMILES for (2E)-4,4-dimethyl-2-(2-methylpropylidene)cyclopentan-1-ol is CC(C)/C=C1\CC(C)(C)CC1O.
What is the InChIKey of (2E)-4,4-dimethyl-2-(2-methylpropylidene)cyclopentan-1-ol?
The InChIKey is YKDXKFYYJVBWAJ-WEVVVXLNSA-N. The full InChI is InChI=1S/C11H20O/c1-8(2)5-9-6-11(3,4)7-10(9)12/h5,8,10,12H,6-7H2,1-4H3/b9-5+.
What are the key properties of (2E)-4,4-dimethyl-2-(2-methylpropylidene)cyclopentan-1-ol?
(2E)-4,4-dimethyl-2-(2-methylpropylidene)cyclopentan-1-ol has a molecular weight of 168.28 g/mol, XLogP of 2.75, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2E)-4,4-dimethyl-2-(2-methylpropylidene)cyclopentan-1-ol is sourced from PubChem (CID 10012301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).