trans-(1R,2S)-2-methyl-2-prop-2-enylcyclopentan-1-ol

C9H16O — CID 70302333

IUPACtrans-(1R,2S)-2-methyl-2-prop-2-enylcyclopentan-1-ol
SMILESC=CC[C@]1(C)CCC[C@H]1O
InChIInChI=1S/C9H16O/c1-3-6-9(2)7-4-5-8(9)10/h3,8,10H,1,4-7H2,2H3/t8-,9-/m1/s1
InChIKeyLYNKUKIMWGBAMJ-RKDXNWHRSA-N
MW140.23 g/mol
LogP2.11
Rot. Bonds2

About trans-(1R,2S)-2-methyl-2-prop-2-enylcyclopentan-1-ol

trans-(1R,2S)-2-methyl-2-prop-2-enylcyclopentan-1-ol (PubChem CID 70302333) has the molecular formula C9H16O and a molecular weight of 140.23 g/mol. Its IUPAC name is trans-(1R,2S)-2-methyl-2-prop-2-enylcyclopentan-1-ol.

Molecular Properties

Compound Nametrans-(1R,2S)-2-methyl-2-prop-2-enylcyclopentan-1-ol
PubChem CID70302333
Molecular FormulaC9H16O
Molecular Weight140.23 g/mol
Exact Mass140.12
IUPAC Nametrans-(1R,2S)-2-methyl-2-prop-2-enylcyclopentan-1-ol
SMILESC=CC[C@]1(C)CCC[C@H]1O
InChIInChI=1S/C9H16O/c1-3-6-9(2)7-4-5-8(9)10/h3,8,10H,1,4-7H2,2H3/t8-,9-/m1/s1
InChIKeyLYNKUKIMWGBAMJ-RKDXNWHRSA-N
XLogP2.11
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
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

Cyclopentanol, 2-(2-hexen-1-yl)-
CID 6438069
[1-(Prop-2-en-1-yl)cyclopentyl]methanol
CID 59913137
2-(Prop-2-en-1-yl)cyclopentan-1-ol
CID 12476296
Cyclopentanol, 2-(2-hexenyl)-
CID 118177
6,6-Dimethyloct-7-en-2-ol
CID 20287636
2-Fluoro-2-prop-2-enylcyclopentan-1-ol
CID 140031737
2-(Pent-4-EN-1-YL)cyclopentan-1-OL
CID 12963384
2-[(Z)-pent-2-enyl]cyclopentan-1-ol
CID 66849133
Spiro[4.5]dec-8-en-4-ol
CID 130126404
3,3-Dimethyloct-7-ene-1,6-diol
CID 141445013
5-(2-Methyl-1-propenyl)-3-cyclohexene-1-spiro-1'-cyclopentan-2'-ol
CID 129742458
2-Allyl-2-methylcyclopentane-1,3-diol
CID 130122188

Frequently Asked Questions

What is the IUPAC name of trans-(1R,2S)-2-methyl-2-prop-2-enylcyclopentan-1-ol?
The IUPAC name of trans-(1R,2S)-2-methyl-2-prop-2-enylcyclopentan-1-ol (CID 70302333) is trans-(1R,2S)-2-methyl-2-prop-2-enylcyclopentan-1-ol.
What is the SMILES notation for trans-(1R,2S)-2-methyl-2-prop-2-enylcyclopentan-1-ol?
The canonical SMILES for trans-(1R,2S)-2-methyl-2-prop-2-enylcyclopentan-1-ol is C=CC[C@]1(C)CCC[C@H]1O.
What is the InChIKey of trans-(1R,2S)-2-methyl-2-prop-2-enylcyclopentan-1-ol?
The InChIKey is LYNKUKIMWGBAMJ-RKDXNWHRSA-N. The full InChI is InChI=1S/C9H16O/c1-3-6-9(2)7-4-5-8(9)10/h3,8,10H,1,4-7H2,2H3/t8-,9-/m1/s1.
What are the key properties of trans-(1R,2S)-2-methyl-2-prop-2-enylcyclopentan-1-ol?
trans-(1R,2S)-2-methyl-2-prop-2-enylcyclopentan-1-ol has a molecular weight of 140.23 g/mol, XLogP of 2.11, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trans-(1R,2S)-2-methyl-2-prop-2-enylcyclopentan-1-ol is sourced from PubChem (CID 70302333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).