trans-(1S,2S)-2-(2-propylimidazol-1-yl)cyclopentan-1-ol

C11H18N2O — CID 102735175

IUPACtrans-(1S,2S)-2-(2-propylimidazol-1-yl)cyclopentan-1-ol
SMILESCCCc1nccn1[C@H]1CCC[C@@H]1O
InChIInChI=1S/C11H18N2O/c1-2-4-11-12-7-8-13(11)9-5-3-6-10(9)14/h7-10,14H,2-6H2,1H3/t9-,10-/m0/s1
InChIKeyOONOLKYISLJQKG-UWVGGRQHSA-N
MW194.28 g/mol
LogP1.92
Rot. Bonds3

About trans-(1S,2S)-2-(2-propylimidazol-1-yl)cyclopentan-1-ol

trans-(1S,2S)-2-(2-propylimidazol-1-yl)cyclopentan-1-ol (PubChem CID 102735175) has the molecular formula C11H18N2O and a molecular weight of 194.28 g/mol. Its IUPAC name is trans-(1S,2S)-2-(2-propylimidazol-1-yl)cyclopentan-1-ol.

Molecular Properties

Compound Nametrans-(1S,2S)-2-(2-propylimidazol-1-yl)cyclopentan-1-ol
PubChem CID102735175
Molecular FormulaC11H18N2O
Molecular Weight194.28 g/mol
Exact Mass194.14
IUPAC Nametrans-(1S,2S)-2-(2-propylimidazol-1-yl)cyclopentan-1-ol
SMILESCCCc1nccn1[C@H]1CCC[C@@H]1O
InChIInChI=1S/C11H18N2O/c1-2-4-11-12-7-8-13(11)9-5-3-6-10(9)14/h7-10,14H,2-6H2,1H3/t9-,10-/m0/s1
InChIKeyOONOLKYISLJQKG-UWVGGRQHSA-N
XLogP1.92
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,2-dimethyl-6-(2-propylimidazol-1-yl)cyclohexan-1-ol
CID 79847201
4-tert-butyl-3-(2-propylimidazol-1-yl)cyclohexan-1-ol
CID 165491999
4-(2-methylbutan-2-yl)-3-(2-propylimidazol-1-yl)cyclohexan-1-ol
CID 165491573
N-ethyl-3-(2-propylimidazol-1-yl)cyclohexan-1-amine
CID 79619406
(1S)-2-(2-methylimidazol-1-yl)cyclohexan-1-ol
CID 126846257
cis-(1S,2R)-2-(2-propan-2-ylimidazol-1-yl)cyclopentan-1-ol
CID 129365655
2-(2-ethylimidazol-1-yl)cyclopentan-1-amine
CID 61405200
azane;1-methyl-2-propylimidazole
CID 174525892
[1-(methylamino)-3-(2-propylimidazol-1-yl)cyclopentyl]methanol
CID 79644477
methanamine;1-methyl-2-propylimidazole
CID 164902083
1-(ethylamino)-3-(2-propylimidazol-1-yl)cyclopentane-1-carboxylic acid
CID 79648637
1-(cyclopropylamino)-3-(2-propylimidazol-1-yl)cyclohexane-1-carboxylic acid
CID 79634409

Frequently Asked Questions

What is the IUPAC name of trans-(1S,2S)-2-(2-propylimidazol-1-yl)cyclopentan-1-ol?
The IUPAC name of trans-(1S,2S)-2-(2-propylimidazol-1-yl)cyclopentan-1-ol (CID 102735175) is trans-(1S,2S)-2-(2-propylimidazol-1-yl)cyclopentan-1-ol.
What is the SMILES notation for trans-(1S,2S)-2-(2-propylimidazol-1-yl)cyclopentan-1-ol?
The canonical SMILES for trans-(1S,2S)-2-(2-propylimidazol-1-yl)cyclopentan-1-ol is CCCc1nccn1[C@H]1CCC[C@@H]1O.
What is the InChIKey of trans-(1S,2S)-2-(2-propylimidazol-1-yl)cyclopentan-1-ol?
The InChIKey is OONOLKYISLJQKG-UWVGGRQHSA-N. The full InChI is InChI=1S/C11H18N2O/c1-2-4-11-12-7-8-13(11)9-5-3-6-10(9)14/h7-10,14H,2-6H2,1H3/t9-,10-/m0/s1.
What are the key properties of trans-(1S,2S)-2-(2-propylimidazol-1-yl)cyclopentan-1-ol?
trans-(1S,2S)-2-(2-propylimidazol-1-yl)cyclopentan-1-ol has a molecular weight of 194.28 g/mol, XLogP of 1.92, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for trans-(1S,2S)-2-(2-propylimidazol-1-yl)cyclopentan-1-ol is sourced from PubChem (CID 102735175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).