cis-(1R,2R)-2-(hydroxymethyl)-2-(3-methylbut-3-enyl)cyclopentan-1-ol

C11H20O2 — CID 10535497

IUPACcis-(1R,2R)-2-(hydroxymethyl)-2-(3-methylbut-3-enyl)cyclopentan-1-ol
SMILESC=C(C)CC[C@@]1(CO)CCC[C@H]1O
InChIInChI=1S/C11H20O2/c1-9(2)5-7-11(8-12)6-3-4-10(11)13/h10,12-13H,1,3-8H2,2H3/t10-,11-/m1/s1
InChIKeyFJEPGZKHBOYVCY-GHMZBOCLSA-N
MW184.28 g/mol
LogP1.87
Rot. Bonds4

About cis-(1R,2R)-2-(hydroxymethyl)-2-(3-methylbut-3-enyl)cyclopentan-1-ol

cis-(1R,2R)-2-(hydroxymethyl)-2-(3-methylbut-3-enyl)cyclopentan-1-ol (PubChem CID 10535497) has the molecular formula C11H20O2 and a molecular weight of 184.28 g/mol. Its IUPAC name is cis-(1R,2R)-2-(hydroxymethyl)-2-(3-methylbut-3-enyl)cyclopentan-1-ol.

Molecular Properties

Compound Namecis-(1R,2R)-2-(hydroxymethyl)-2-(3-methylbut-3-enyl)cyclopentan-1-ol
PubChem CID10535497
Molecular FormulaC11H20O2
Molecular Weight184.28 g/mol
Exact Mass184.15
IUPAC Namecis-(1R,2R)-2-(hydroxymethyl)-2-(3-methylbut-3-enyl)cyclopentan-1-ol
SMILESC=C(C)CC[C@@]1(CO)CCC[C@H]1O
InChIInChI=1S/C11H20O2/c1-9(2)5-7-11(8-12)6-3-4-10(11)13/h10,12-13H,1,3-8H2,2H3/t10-,11-/m1/s1
InChIKeyFJEPGZKHBOYVCY-GHMZBOCLSA-N
XLogP1.87
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 51.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze cis-(1R,2R)-2-(hydroxymethyl)-2-(3-methylbut-3-enyl)cyclopentan-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6,8,8-Trimethyl-5-methylidenenonan-2-ol
CID 85699305
2-Allyl-2-methylcyclopentane-1,3-diol
CID 130122188
(1R,2R)-1-cyclopentyl-4-methyl-2-prop-1-en-2-ylpentane-1,3-diol
CID 134904108
1-(4,4-Dimethyl-2-methylidenecyclopentyl)hexan-1-ol
CID 134906309
(1R,2R)-1-cyclopentyl-2-prop-1-en-2-ylpentane-1,3-diol
CID 134978835
(1R,2S,4R)-2-[(1R)-1-hydroxypropyl]-2-methyl-4-prop-1-en-2-ylcyclopentan-1-ol
CID 139125528
1-(3-Hydroxy-4,4-dimethylpent-1-en-2-yl)cyclopentan-1-ol
CID 15442004
1-[(3S)-3-hydroxy-4,4-dimethylpent-1-en-2-yl]cyclopentan-1-ol
CID 15939184
(5R,9R)-4-methylidenespiro[4.4]nonan-9-ol
CID 102353152
rac-(1R,2S)-2-(2-methylprop-2-en-1-yl)cyclopentan-1-ol
CID 165598747
trans-(1S,2R)-2-methyl-2-prop-2-enylcyclopentan-1-ol
CID 14617442
cis-(1R,2R)-2-methyl-2-prop-2-enylcyclopentan-1-ol
CID 14617443

Frequently Asked Questions

What is the IUPAC name of cis-(1R,2R)-2-(hydroxymethyl)-2-(3-methylbut-3-enyl)cyclopentan-1-ol?
The IUPAC name of cis-(1R,2R)-2-(hydroxymethyl)-2-(3-methylbut-3-enyl)cyclopentan-1-ol (CID 10535497) is cis-(1R,2R)-2-(hydroxymethyl)-2-(3-methylbut-3-enyl)cyclopentan-1-ol.
What is the SMILES notation for cis-(1R,2R)-2-(hydroxymethyl)-2-(3-methylbut-3-enyl)cyclopentan-1-ol?
The canonical SMILES for cis-(1R,2R)-2-(hydroxymethyl)-2-(3-methylbut-3-enyl)cyclopentan-1-ol is C=C(C)CC[C@@]1(CO)CCC[C@H]1O.
What is the InChIKey of cis-(1R,2R)-2-(hydroxymethyl)-2-(3-methylbut-3-enyl)cyclopentan-1-ol?
The InChIKey is FJEPGZKHBOYVCY-GHMZBOCLSA-N. The full InChI is InChI=1S/C11H20O2/c1-9(2)5-7-11(8-12)6-3-4-10(11)13/h10,12-13H,1,3-8H2,2H3/t10-,11-/m1/s1.
What are the key properties of cis-(1R,2R)-2-(hydroxymethyl)-2-(3-methylbut-3-enyl)cyclopentan-1-ol?
cis-(1R,2R)-2-(hydroxymethyl)-2-(3-methylbut-3-enyl)cyclopentan-1-ol has a molecular weight of 184.28 g/mol, XLogP of 1.87, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cis-(1R,2R)-2-(hydroxymethyl)-2-(3-methylbut-3-enyl)cyclopentan-1-ol is sourced from PubChem (CID 10535497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).