3-imidazol-1-ylcyclobutan-1-ol

C7H10N2O — CID 131068227

IUPAC3-imidazol-1-ylcyclobutan-1-ol
SMILESOC1CC(n2ccnc2)C1
InChIInChI=1S/C7H10N2O/c10-7-3-6(4-7)9-2-1-8-5-9/h1-2,5-7,10H,3-4H2
InChIKeyMWYRMETUPZGTRP-UHFFFAOYSA-N
MW138.17 g/mol
LogP0.58
Rot. Bonds1

About 3-imidazol-1-ylcyclobutan-1-ol

3-imidazol-1-ylcyclobutan-1-ol (PubChem CID 131068227) has the molecular formula C7H10N2O and a molecular weight of 138.17 g/mol. Its IUPAC name is 3-imidazol-1-ylcyclobutan-1-ol.

Molecular Properties

Compound Name3-imidazol-1-ylcyclobutan-1-ol
PubChem CID131068227
Molecular FormulaC7H10N2O
Molecular Weight138.17 g/mol
Exact Mass138.08
IUPAC Name3-imidazol-1-ylcyclobutan-1-ol
SMILESOC1CC(n2ccnc2)C1
InChIInChI=1S/C7H10N2O/c10-7-3-6(4-7)9-2-1-8-5-9/h1-2,5-7,10H,3-4H2
InChIKeyMWYRMETUPZGTRP-UHFFFAOYSA-N
XLogP0.58
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.17
LogP ≤ 50.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[(1S,5R)-3-bicyclo[3.1.0]hexanyl]imidazole
CID 126638711
1-(azetidin-3-yl)imidazole
CID 22007463
1-cyclopentylimidazole;ethane;methanol
CID 144877752
4-imidazol-1-ylcyclohexan-1-amine
CID 62808161
(1R)-2-imidazol-1-ylcyclopentan-1-ol
CID 126638483
2,6-di(imidazol-1-yl)cyclohexan-1-ol
CID 91619575
1-(oxolan-3-yl)imidazole
CID 63810500
ethane;4-imidazol-1-ylpiperidine
CID 143122198
N-[(3-imidazol-1-ylcyclobutyl)methyl]-2-methylbutan-1-amine
CID 165486818
1-(4-ethylcyclohexyl)imidazole
CID 64776117
1-[(3R)-3-methoxycyclohexyl]imidazole
CID 175222056
1-(3-imidazol-1-ylazetidin-1-yl)prop-2-en-1-one
CID 167872265

Frequently Asked Questions

What is the IUPAC name of 3-imidazol-1-ylcyclobutan-1-ol?
The IUPAC name of 3-imidazol-1-ylcyclobutan-1-ol (CID 131068227) is 3-imidazol-1-ylcyclobutan-1-ol.
What is the SMILES notation for 3-imidazol-1-ylcyclobutan-1-ol?
The canonical SMILES for 3-imidazol-1-ylcyclobutan-1-ol is OC1CC(n2ccnc2)C1.
What is the InChIKey of 3-imidazol-1-ylcyclobutan-1-ol?
The InChIKey is MWYRMETUPZGTRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O/c10-7-3-6(4-7)9-2-1-8-5-9/h1-2,5-7,10H,3-4H2.
What are the key properties of 3-imidazol-1-ylcyclobutan-1-ol?
3-imidazol-1-ylcyclobutan-1-ol has a molecular weight of 138.17 g/mol, XLogP of 0.58, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-imidazol-1-ylcyclobutan-1-ol is sourced from PubChem (CID 131068227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).