2-(1H-imidazol-2-yl)cycloheptan-1-ol

C10H16N2O — CID 19908898

IUPAC2-(1H-imidazol-2-yl)cycloheptan-1-ol
SMILESOC1CCCCCC1c1ncc[nH]1
InChIInChI=1S/C10H16N2O/c13-9-5-3-1-2-4-8(9)10-11-6-7-12-10/h6-9,13H,1-5H2,(H,11,12)
InChIKeyCDYTZWUKBPTGMI-UHFFFAOYSA-N
MW180.25 g/mol
LogP1.82
Rot. Bonds1

About 2-(1H-imidazol-2-yl)cycloheptan-1-ol

2-(1H-imidazol-2-yl)cycloheptan-1-ol (PubChem CID 19908898) has the molecular formula C10H16N2O and a molecular weight of 180.25 g/mol. Its IUPAC name is 2-(1H-imidazol-2-yl)cycloheptan-1-ol.

Molecular Properties

Compound Name2-(1H-imidazol-2-yl)cycloheptan-1-ol
PubChem CID19908898
Molecular FormulaC10H16N2O
Molecular Weight180.25 g/mol
Exact Mass180.13
IUPAC Name2-(1H-imidazol-2-yl)cycloheptan-1-ol
SMILESOC1CCCCCC1c1ncc[nH]1
InChIInChI=1S/C10H16N2O/c13-9-5-3-1-2-4-8(9)10-11-6-7-12-10/h6-9,13H,1-5H2,(H,11,12)
InChIKeyCDYTZWUKBPTGMI-UHFFFAOYSA-N
XLogP1.82
TPSA48.91 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.25
LogP ≤ 51.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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Imidazolylmethyl spiro[4.5]decanol
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2-[[[1-(Difluoromethyl)imidazol-2-yl]methylamino]methyl]cyclohexan-1-ol
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CID 103310567
[1-(1H-imidazol-2-ylmethyl)-3-isobutylpiperidin-3-yl]methanol
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1H-Imidazole-2-methanol, alpha-heptadecyl-
CID 566962
Cyclobutanol, 1-(1H-imidazol-2-yl)-2-tetradecyl-
CID 573716
1-(1H-imidazol-2-yl)tridecan-1-ol
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3-cyclohexyl-1-(1H-imidazol-2-yl)propan-1-ol
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Frequently Asked Questions

What is the IUPAC name of 2-(1H-imidazol-2-yl)cycloheptan-1-ol?
The IUPAC name of 2-(1H-imidazol-2-yl)cycloheptan-1-ol (CID 19908898) is 2-(1H-imidazol-2-yl)cycloheptan-1-ol.
What is the SMILES notation for 2-(1H-imidazol-2-yl)cycloheptan-1-ol?
The canonical SMILES for 2-(1H-imidazol-2-yl)cycloheptan-1-ol is OC1CCCCCC1c1ncc[nH]1.
What is the InChIKey of 2-(1H-imidazol-2-yl)cycloheptan-1-ol?
The InChIKey is CDYTZWUKBPTGMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O/c13-9-5-3-1-2-4-8(9)10-11-6-7-12-10/h6-9,13H,1-5H2,(H,11,12).
What are the key properties of 2-(1H-imidazol-2-yl)cycloheptan-1-ol?
2-(1H-imidazol-2-yl)cycloheptan-1-ol has a molecular weight of 180.25 g/mol, XLogP of 1.82, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1H-imidazol-2-yl)cycloheptan-1-ol is sourced from PubChem (CID 19908898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).