3-(3-methylbut-3-enyl)cyclopent-2-en-1-ol

C10H16O — CID 114477354

IUPAC3-(3-methylbut-3-enyl)cyclopent-2-en-1-ol
SMILESC=C(C)CCC1=CC(O)CC1
InChIInChI=1S/C10H16O/c1-8(2)3-4-9-5-6-10(11)7-9/h7,10-11H,1,3-6H2,2H3
InChIKeyFTEORDRQGBLULH-UHFFFAOYSA-N
MW152.24 g/mol
LogP2.42
Rot. Bonds3

About 3-(3-methylbut-3-enyl)cyclopent-2-en-1-ol

3-(3-methylbut-3-enyl)cyclopent-2-en-1-ol (PubChem CID 114477354) has the molecular formula C10H16O and a molecular weight of 152.24 g/mol. Its IUPAC name is 3-(3-methylbut-3-enyl)cyclopent-2-en-1-ol.

Molecular Properties

Compound Name3-(3-methylbut-3-enyl)cyclopent-2-en-1-ol
PubChem CID114477354
Molecular FormulaC10H16O
Molecular Weight152.24 g/mol
Exact Mass152.12
IUPAC Name3-(3-methylbut-3-enyl)cyclopent-2-en-1-ol
SMILESC=C(C)CCC1=CC(O)CC1
InChIInChI=1S/C10H16O/c1-8(2)3-4-9-5-6-10(11)7-9/h7,10-11H,1,3-6H2,2H3
InChIKeyFTEORDRQGBLULH-UHFFFAOYSA-N
XLogP2.42
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.24
LogP ≤ 52.42
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

3-(3-methylbut-3-enyl)cyclohex-2-en-1-amine
CID 114477333
3-butylcyclopent-2-en-1-ol
CID 65174589
3-hept-6-enylcyclopent-2-en-1-ol
CID 107010526
(1R)-3-propylcyclohex-2-en-1-ol
CID 101101480
ethyl-[4-(3-hydroxycyclopenten-1-yl)butyl]phosphinic acid
CID 91265126
3-(2-methylpentyl)cyclopent-2-en-1-ol
CID 65174593
3-[(4R)-4-prop-1-en-2-ylcyclohexen-1-yl]propanoic acid
CID 10583976
(1R)-3-ethylcyclohex-2-en-1-ol
CID 11252010
1-(methylsulfanylmethyl)-4-prop-1-en-2-ylcyclohexene
CID 71343459
3-[(2,5-dimethylphenyl)methyl]cyclopent-2-en-1-ol
CID 65174483
3-(3-ethylsulfonylpropyl)cyclohex-2-en-1-ol
CID 65177264
3-hept-6-enylcyclohex-2-en-1-ol
CID 107010524

Frequently Asked Questions

What is the IUPAC name of 3-(3-methylbut-3-enyl)cyclopent-2-en-1-ol?
The IUPAC name of 3-(3-methylbut-3-enyl)cyclopent-2-en-1-ol (CID 114477354) is 3-(3-methylbut-3-enyl)cyclopent-2-en-1-ol.
What is the SMILES notation for 3-(3-methylbut-3-enyl)cyclopent-2-en-1-ol?
The canonical SMILES for 3-(3-methylbut-3-enyl)cyclopent-2-en-1-ol is C=C(C)CCC1=CC(O)CC1.
What is the InChIKey of 3-(3-methylbut-3-enyl)cyclopent-2-en-1-ol?
The InChIKey is FTEORDRQGBLULH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16O/c1-8(2)3-4-9-5-6-10(11)7-9/h7,10-11H,1,3-6H2,2H3.
What are the key properties of 3-(3-methylbut-3-enyl)cyclopent-2-en-1-ol?
3-(3-methylbut-3-enyl)cyclopent-2-en-1-ol has a molecular weight of 152.24 g/mol, XLogP of 2.42, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-methylbut-3-enyl)cyclopent-2-en-1-ol is sourced from PubChem (CID 114477354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).