cis-(1R,2S)-2-pent-2-ynylcyclopentan-1-ol

C10H16O — CID 131067468

IUPACcis-(1R,2S)-2-pent-2-ynylcyclopentan-1-ol
SMILESCCC#CC[C@@H]1CCC[C@H]1O
InChIInChI=1S/C10H16O/c1-2-3-4-6-9-7-5-8-10(9)11/h9-11H,2,5-8H2,1H3/t9-,10-/m1/s1
InChIKeyWYWZEQMTSNOAQZ-NXEZZACHSA-N
MW152.24 g/mol
LogP1.95
Rot. Bonds1

About cis-(1R,2S)-2-pent-2-ynylcyclopentan-1-ol

cis-(1R,2S)-2-pent-2-ynylcyclopentan-1-ol (PubChem CID 131067468) has the molecular formula C10H16O and a molecular weight of 152.24 g/mol. Its IUPAC name is cis-(1R,2S)-2-pent-2-ynylcyclopentan-1-ol.

Molecular Properties

Compound Namecis-(1R,2S)-2-pent-2-ynylcyclopentan-1-ol
PubChem CID131067468
Molecular FormulaC10H16O
Molecular Weight152.24 g/mol
Exact Mass152.12
IUPAC Namecis-(1R,2S)-2-pent-2-ynylcyclopentan-1-ol
SMILESCCC#CC[C@@H]1CCC[C@H]1O
InChIInChI=1S/C10H16O/c1-2-3-4-6-9-7-5-8-10(9)11/h9-11H,2,5-8H2,1H3/t9-,10-/m1/s1
InChIKeyWYWZEQMTSNOAQZ-NXEZZACHSA-N
XLogP1.95
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.24
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

trans-(1R,2R)-2-hept-2-ynylcyclopentan-1-ol
CID 12791819
cis-(1R,2S)-2-prop-2-ynylcyclopentan-1-ol
CID 12791811
trans-(1S,2S)-2-prop-2-ynylcyclopentan-1-ol
CID 12791810
ethane;2-ethylcyclopentan-1-ol
CID 144624771
cis-(1R,2S)-2-(3-tributylstannylprop-2-ynyl)cyclohexan-1-ol
CID 177468630
(1R)-2-propylcyclohexan-1-ol
CID 144627240
trans-(1R,2S)-2-hexylcyclopentan-1-ol
CID 10797255
cis-(1S,2S)-2-hexylcyclopentan-1-ol
CID 10654739
cis-(1S,2R)-2-(methylaminomethyl)cyclopentan-1-ol
CID 13133890
2-pent-3-ynylcyclohexan-1-ol
CID 104810024
cis-(1R,2S)-2-(2-hydroxyethyl)cyclohexan-1-ol
CID 71357650
trans-(1S,2S)-2-(aminomethyl)cyclopentan-1-ol;hydrochloride
CID 134691166

Frequently Asked Questions

What is the IUPAC name of cis-(1R,2S)-2-pent-2-ynylcyclopentan-1-ol?
The IUPAC name of cis-(1R,2S)-2-pent-2-ynylcyclopentan-1-ol (CID 131067468) is cis-(1R,2S)-2-pent-2-ynylcyclopentan-1-ol.
What is the SMILES notation for cis-(1R,2S)-2-pent-2-ynylcyclopentan-1-ol?
The canonical SMILES for cis-(1R,2S)-2-pent-2-ynylcyclopentan-1-ol is CCC#CC[C@@H]1CCC[C@H]1O.
What is the InChIKey of cis-(1R,2S)-2-pent-2-ynylcyclopentan-1-ol?
The InChIKey is WYWZEQMTSNOAQZ-NXEZZACHSA-N. The full InChI is InChI=1S/C10H16O/c1-2-3-4-6-9-7-5-8-10(9)11/h9-11H,2,5-8H2,1H3/t9-,10-/m1/s1.
What are the key properties of cis-(1R,2S)-2-pent-2-ynylcyclopentan-1-ol?
cis-(1R,2S)-2-pent-2-ynylcyclopentan-1-ol has a molecular weight of 152.24 g/mol, XLogP of 1.95, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cis-(1R,2S)-2-pent-2-ynylcyclopentan-1-ol is sourced from PubChem (CID 131067468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).