1-[1-[2-(1H-imidazol-2-yl)imidazol-1-yl]ethyl]cyclopropan-1-ol

C11H14N4O — CID 155919021

IUPAC1-[1-[2-(1H-imidazol-2-yl)imidazol-1-yl]ethyl]cyclopropan-1-ol
SMILESCC(n1ccnc1-c1ncc[nH]1)C1(O)CC1
InChIInChI=1S/C11H14N4O/c1-8(11(16)2-3-11)15-7-6-14-10(15)9-12-4-5-13-9/h4-8,16H,2-3H2,1H3,(H,12,13)
InChIKeyPBQPMCXVENBDEU-UHFFFAOYSA-N
MW218.26 g/mol
LogP1.36
Rot. Bonds3

About 1-[1-[2-(1H-imidazol-2-yl)imidazol-1-yl]ethyl]cyclopropan-1-ol

1-[1-[2-(1H-imidazol-2-yl)imidazol-1-yl]ethyl]cyclopropan-1-ol (PubChem CID 155919021) has the molecular formula C11H14N4O and a molecular weight of 218.26 g/mol. Its IUPAC name is 1-[1-[2-(1H-imidazol-2-yl)imidazol-1-yl]ethyl]cyclopropan-1-ol.

Molecular Properties

Compound Name1-[1-[2-(1H-imidazol-2-yl)imidazol-1-yl]ethyl]cyclopropan-1-ol
PubChem CID155919021
Molecular FormulaC11H14N4O
Molecular Weight218.26 g/mol
Exact Mass218.12
IUPAC Name1-[1-[2-(1H-imidazol-2-yl)imidazol-1-yl]ethyl]cyclopropan-1-ol
SMILESCC(n1ccnc1-c1ncc[nH]1)C1(O)CC1
InChIInChI=1S/C11H14N4O/c1-8(11(16)2-3-11)15-7-6-14-10(15)9-12-4-5-13-9/h4-8,16H,2-3H2,1H3,(H,12,13)
InChIKeyPBQPMCXVENBDEU-UHFFFAOYSA-N
XLogP1.36
TPSA66.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 51.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-[1-[2-(furan-2-yl)imidazol-1-yl]ethyl]cyclopropan-1-ol
CID 155918481
1-[1-[2-(3-fluorophenyl)imidazol-1-yl]ethyl]cyclopropan-1-ol
CID 156584872
1-(4,4-difluorocyclohexyl)-2-(1H-imidazol-2-yl)imidazole
CID 155913701
2-(1H-imidazol-2-yl)-1-(2,4,6-trimethylphenyl)imidazole
CID 140703360
1-[(1S,2R,4R)-2-bicyclo[2.2.1]heptanyl]-2-(1H-imidazol-2-yl)imidazole
CID 155915295
5-[[2-(1H-imidazol-2-yl)imidazol-1-yl]methyl]-2,4-dimethyl-1,3-thiazole
CID 155909523
tris(2-(1H-imidazol-2-yl)-1H-imidazole);ruthenium
CID 20805474
2-(1H-imidazol-2-yl)-1-(1,2,2-triphenylethenyl)imidazole
CID 175205519
2-(1H-imidazol-2-yl)-1-(thiophen-2-ylmethyl)imidazole
CID 15057077
2-(1H-imidazol-2-yl)-6-(1-methylimidazol-2-yl)pyridine
CID 70653614
5-(hydroxymethyl)-4-(1H-imidazol-2-yl)-2-methylpyridin-3-ol;5-(hydroxymethyl)-2-methyl-4-(1-methylimidazol-2-yl)pyridin-3-ol;methane
CID 158333850
dodecanedioic acid;bis(2-[[2-(1H-imidazol-2-yl)imidazol-1-yl]methyl]pyridine)
CID 139050439

Frequently Asked Questions

What is the IUPAC name of 1-[1-[2-(1H-imidazol-2-yl)imidazol-1-yl]ethyl]cyclopropan-1-ol?
The IUPAC name of 1-[1-[2-(1H-imidazol-2-yl)imidazol-1-yl]ethyl]cyclopropan-1-ol (CID 155919021) is 1-[1-[2-(1H-imidazol-2-yl)imidazol-1-yl]ethyl]cyclopropan-1-ol.
What is the SMILES notation for 1-[1-[2-(1H-imidazol-2-yl)imidazol-1-yl]ethyl]cyclopropan-1-ol?
The canonical SMILES for 1-[1-[2-(1H-imidazol-2-yl)imidazol-1-yl]ethyl]cyclopropan-1-ol is CC(n1ccnc1-c1ncc[nH]1)C1(O)CC1.
What is the InChIKey of 1-[1-[2-(1H-imidazol-2-yl)imidazol-1-yl]ethyl]cyclopropan-1-ol?
The InChIKey is PBQPMCXVENBDEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4O/c1-8(11(16)2-3-11)15-7-6-14-10(15)9-12-4-5-13-9/h4-8,16H,2-3H2,1H3,(H,12,13).
What are the key properties of 1-[1-[2-(1H-imidazol-2-yl)imidazol-1-yl]ethyl]cyclopropan-1-ol?
1-[1-[2-(1H-imidazol-2-yl)imidazol-1-yl]ethyl]cyclopropan-1-ol has a molecular weight of 218.26 g/mol, XLogP of 1.36, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-[2-(1H-imidazol-2-yl)imidazol-1-yl]ethyl]cyclopropan-1-ol is sourced from PubChem (CID 155919021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).