[1-[2-(2-methylimidazol-1-yl)ethyl]imidazol-2-yl]methanol

C10H14N4O — CID 62223688

IUPAC[1-[2-(2-methylimidazol-1-yl)ethyl]imidazol-2-yl]methanol
SMILESCc1nccn1CCn1ccnc1CO
InChIInChI=1S/C10H14N4O/c1-9-11-2-4-13(9)6-7-14-5-3-12-10(14)8-15/h2-5,15H,6-8H2,1H3
InChIKeyOUXBCRHGDHTQNC-UHFFFAOYSA-N
MW206.25 g/mol
LogP0.58
Rot. Bonds4

About [1-[2-(2-methylimidazol-1-yl)ethyl]imidazol-2-yl]methanol

[1-[2-(2-methylimidazol-1-yl)ethyl]imidazol-2-yl]methanol (PubChem CID 62223688) has the molecular formula C10H14N4O and a molecular weight of 206.25 g/mol. Its IUPAC name is [1-[2-(2-methylimidazol-1-yl)ethyl]imidazol-2-yl]methanol.

Molecular Properties

Compound Name[1-[2-(2-methylimidazol-1-yl)ethyl]imidazol-2-yl]methanol
PubChem CID62223688
Molecular FormulaC10H14N4O
Molecular Weight206.25 g/mol
Exact Mass206.12
IUPAC Name[1-[2-(2-methylimidazol-1-yl)ethyl]imidazol-2-yl]methanol
SMILESCc1nccn1CCn1ccnc1CO
InChIInChI=1S/C10H14N4O/c1-9-11-2-4-13(9)6-7-14-5-3-12-10(14)8-15/h2-5,15H,6-8H2,1H3
InChIKeyOUXBCRHGDHTQNC-UHFFFAOYSA-N
XLogP0.58
TPSA55.87 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.25
LogP ≤ 50.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-methyl-2-[2-(2-methylimidazol-1-yl)ethyl]imidazole
CID 114531881
tris(2-methyl-1-propylimidazole);trihydroiodide
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2-[2-(2-methylimidazol-1-yl)ethylamino]propan-1-ol
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[1-[2-(2-methylimidazol-1-yl)ethyl]indol-3-yl]methanol
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5-[2-(2-methylimidazol-1-yl)ethylamino]pentan-1-ol
CID 107317411
N-[4-(2-methylimidazol-1-yl)but-1-en-2-yl]hydroxylamine
CID 59872483
1-[2-(2-methylimidazol-1-yl)ethyl]piperidine
CID 61225679
3-(2-methylimidazol-1-yl)propylhydrazine
CID 123546273
[4-[(2-methylimidazol-1-yl)methyl]phenyl]methanol
CID 70515805
1-[2-(2-methylimidazol-1-yl)ethyl]imidazole-2-carbaldehyde
CID 62223868

Frequently Asked Questions

What is the IUPAC name of [1-[2-(2-methylimidazol-1-yl)ethyl]imidazol-2-yl]methanol?
The IUPAC name of [1-[2-(2-methylimidazol-1-yl)ethyl]imidazol-2-yl]methanol (CID 62223688) is [1-[2-(2-methylimidazol-1-yl)ethyl]imidazol-2-yl]methanol.
What is the SMILES notation for [1-[2-(2-methylimidazol-1-yl)ethyl]imidazol-2-yl]methanol?
The canonical SMILES for [1-[2-(2-methylimidazol-1-yl)ethyl]imidazol-2-yl]methanol is Cc1nccn1CCn1ccnc1CO.
What is the InChIKey of [1-[2-(2-methylimidazol-1-yl)ethyl]imidazol-2-yl]methanol?
The InChIKey is OUXBCRHGDHTQNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4O/c1-9-11-2-4-13(9)6-7-14-5-3-12-10(14)8-15/h2-5,15H,6-8H2,1H3.
What are the key properties of [1-[2-(2-methylimidazol-1-yl)ethyl]imidazol-2-yl]methanol?
[1-[2-(2-methylimidazol-1-yl)ethyl]imidazol-2-yl]methanol has a molecular weight of 206.25 g/mol, XLogP of 0.58, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[2-(2-methylimidazol-1-yl)ethyl]imidazol-2-yl]methanol is sourced from PubChem (CID 62223688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).