1,2-bis(6-methyl-1H-benzimidazol-2-yl)ethanol

C18H18N4O — CID 102488846

IUPAC1,2-bis(6-methyl-1H-benzimidazol-2-yl)ethanol
SMILESCc1ccc2nc(CC(O)c3nc4ccc(C)cc4[nH]3)[nH]c2c1
InChIInChI=1S/C18H18N4O/c1-10-3-5-12-14(7-10)20-17(19-12)9-16(23)18-21-13-6-4-11(2)8-15(13)22-18/h3-8,16,23H,9H2,1-2H3,(H,19,20)(H,21,22)
InChIKeyXIDOIGNSHFQNPL-UHFFFAOYSA-N
MW306.37 g/mol
LogP3.33
Rot. Bonds3

About 1,2-bis(6-methyl-1H-benzimidazol-2-yl)ethanol

1,2-bis(6-methyl-1H-benzimidazol-2-yl)ethanol (PubChem CID 102488846) has the molecular formula C18H18N4O and a molecular weight of 306.37 g/mol. Its IUPAC name is 1,2-bis(6-methyl-1H-benzimidazol-2-yl)ethanol.

Molecular Properties

Compound Name1,2-bis(6-methyl-1H-benzimidazol-2-yl)ethanol
PubChem CID102488846
Molecular FormulaC18H18N4O
Molecular Weight306.37 g/mol
Exact Mass306.15
IUPAC Name1,2-bis(6-methyl-1H-benzimidazol-2-yl)ethanol
SMILESCc1ccc2nc(CC(O)c3nc4ccc(C)cc4[nH]3)[nH]c2c1
InChIInChI=1S/C18H18N4O/c1-10-3-5-12-14(7-10)20-17(19-12)9-16(23)18-21-13-6-4-11(2)8-15(13)22-18/h3-8,16,23H,9H2,1-2H3,(H,19,20)(H,21,22)
InChIKeyXIDOIGNSHFQNPL-UHFFFAOYSA-N
XLogP3.33
TPSA77.59 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.37
LogP ≤ 53.33
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 1,2-bis(6-methyl-1H-benzimidazol-2-yl)ethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(1R,2R)-1,2-bis(6-methyl-1H-benzimidazol-2-yl)ethane-1,2-diol
CID 1090298
1,2-bis(6-methyl-1H-benzimidazol-2-yl)ethane-1,2-diol
CID 653921
2-(3,4-dimethyl-2-pyridinyl)-1-(6-methyl-1H-benzimidazol-2-yl)ethanol
CID 163448451
methanol;(1S)-1-(6-methyl-1H-benzimidazol-2-yl)ethanamine
CID 143560224
4-[1-(6-methyl-1H-benzimidazol-2-yl)propan-2-yl]aniline
CID 104501898
1-(6-methyl-1H-benzimidazol-2-yl)ethylphosphonic acid
CID 23453418
2-(6-methyl-1H-benzimidazol-2-yl)ethanamine;dihydrochloride
CID 19195701
3-methyl-1-(6-methyl-1H-benzimidazol-2-yl)butan-1-amine
CID 43379497
2-[(2R)-1-methoxypropan-2-yl]-6-methyl-1H-benzimidazole
CID 143794586
2-methyl-1-(6-methyl-1H-benzimidazol-2-yl)-N,N-bis(prop-2-enyl)propan-1-amine
CID 82336531
N,N-dimethyl-2-(6-methyl-1H-benzimidazol-2-yl)ethanamine
CID 45040735
2-[(6-methyl-1H-benzimidazol-2-yl)methyl]phenol
CID 80740442

Frequently Asked Questions

What is the IUPAC name of 1,2-bis(6-methyl-1H-benzimidazol-2-yl)ethanol?
The IUPAC name of 1,2-bis(6-methyl-1H-benzimidazol-2-yl)ethanol (CID 102488846) is 1,2-bis(6-methyl-1H-benzimidazol-2-yl)ethanol.
What is the SMILES notation for 1,2-bis(6-methyl-1H-benzimidazol-2-yl)ethanol?
The canonical SMILES for 1,2-bis(6-methyl-1H-benzimidazol-2-yl)ethanol is Cc1ccc2nc(CC(O)c3nc4ccc(C)cc4[nH]3)[nH]c2c1.
What is the InChIKey of 1,2-bis(6-methyl-1H-benzimidazol-2-yl)ethanol?
The InChIKey is XIDOIGNSHFQNPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N4O/c1-10-3-5-12-14(7-10)20-17(19-12)9-16(23)18-21-13-6-4-11(2)8-15(13)22-18/h3-8,16,23H,9H2,1-2H3,(H,19,20)(H,21,22).
What are the key properties of 1,2-bis(6-methyl-1H-benzimidazol-2-yl)ethanol?
1,2-bis(6-methyl-1H-benzimidazol-2-yl)ethanol has a molecular weight of 306.37 g/mol, XLogP of 3.33, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-bis(6-methyl-1H-benzimidazol-2-yl)ethanol is sourced from PubChem (CID 102488846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).