2-(2-amino-5-fluoro-6-methylbenzimidazol-1-yl)cyclohexan-1-ol

C14H18FN3O — CID 103592912

IUPAC2-(2-amino-5-fluoro-6-methylbenzimidazol-1-yl)cyclohexan-1-ol
SMILESCc1cc2c(cc1F)nc(N)n2C1CCCCC1O
InChIInChI=1S/C14H18FN3O/c1-8-6-12-10(7-9(8)15)17-14(16)18(12)11-4-2-3-5-13(11)19/h6-7,11,13,19H,2-5H2,1H3,(H2,16,17)
InChIKeyXEHQJYOKQIDGGR-UHFFFAOYSA-N
MW263.32 g/mol
LogP2.54
Rot. Bonds1

About 2-(2-amino-5-fluoro-6-methylbenzimidazol-1-yl)cyclohexan-1-ol

2-(2-amino-5-fluoro-6-methylbenzimidazol-1-yl)cyclohexan-1-ol (PubChem CID 103592912) has the molecular formula C14H18FN3O and a molecular weight of 263.32 g/mol. Its IUPAC name is 2-(2-amino-5-fluoro-6-methylbenzimidazol-1-yl)cyclohexan-1-ol.

Molecular Properties

Compound Name2-(2-amino-5-fluoro-6-methylbenzimidazol-1-yl)cyclohexan-1-ol
PubChem CID103592912
Molecular FormulaC14H18FN3O
Molecular Weight263.32 g/mol
Exact Mass263.14
IUPAC Name2-(2-amino-5-fluoro-6-methylbenzimidazol-1-yl)cyclohexan-1-ol
SMILESCc1cc2c(cc1F)nc(N)n2C1CCCCC1O
InChIInChI=1S/C14H18FN3O/c1-8-6-12-10(7-9(8)15)17-14(16)18(12)11-4-2-3-5-13(11)19/h6-7,11,13,19H,2-5H2,1H3,(H2,16,17)
InChIKeyXEHQJYOKQIDGGR-UHFFFAOYSA-N
XLogP2.54
TPSA64.07 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.32
LogP ≤ 52.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-amino-5-fluoro-6-methoxybenzimidazol-1-yl)cyclohexan-1-ol
CID 63598582
1-(1-azabicyclo[2.2.2]octan-3-yl)-5-fluoro-6-methylbenzimidazol-2-amine
CID 103592630
5-fluoro-6-methyl-1-(thian-3-yl)benzimidazol-2-amine
CID 103593149
1-(1,2,3,5,6,7,8,8a-octahydroindolizin-7-yl)-5-fluoro-6-methylbenzimidazol-2-amine
CID 103593055
5-chloro-6-fluoro-1-(2-methylcyclohexyl)benzimidazol-2-amine
CID 66079071
6-bromo-1-(2-ethylcyclohexyl)-5-fluorobenzimidazol-2-amine
CID 116738177
2-(2-amino-4-fluorobenzimidazol-1-yl)cyclohexan-1-ol
CID 62359258
5-fluoro-6-methyl-1-[(2-methylcyclohexyl)methyl]benzimidazol-2-amine
CID 103592850
1-[2-[cyclopentyl(methyl)amino]ethyl]-5-fluoro-6-methylbenzimidazol-2-amine
CID 103592949
2-(5-amino-2-methylbenzimidazol-1-yl)cyclohexan-1-ol
CID 62506404
5-chloro-1-(2,3-dimethylcyclohexyl)-6-fluorobenzimidazol-2-amine
CID 66078877
2-(chloromethyl)-1-cyclobutyl-5-fluoro-6-methylbenzimidazole
CID 103593655

Frequently Asked Questions

What is the IUPAC name of 2-(2-amino-5-fluoro-6-methylbenzimidazol-1-yl)cyclohexan-1-ol?
The IUPAC name of 2-(2-amino-5-fluoro-6-methylbenzimidazol-1-yl)cyclohexan-1-ol (CID 103592912) is 2-(2-amino-5-fluoro-6-methylbenzimidazol-1-yl)cyclohexan-1-ol.
What is the SMILES notation for 2-(2-amino-5-fluoro-6-methylbenzimidazol-1-yl)cyclohexan-1-ol?
The canonical SMILES for 2-(2-amino-5-fluoro-6-methylbenzimidazol-1-yl)cyclohexan-1-ol is Cc1cc2c(cc1F)nc(N)n2C1CCCCC1O.
What is the InChIKey of 2-(2-amino-5-fluoro-6-methylbenzimidazol-1-yl)cyclohexan-1-ol?
The InChIKey is XEHQJYOKQIDGGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18FN3O/c1-8-6-12-10(7-9(8)15)17-14(16)18(12)11-4-2-3-5-13(11)19/h6-7,11,13,19H,2-5H2,1H3,(H2,16,17).
What are the key properties of 2-(2-amino-5-fluoro-6-methylbenzimidazol-1-yl)cyclohexan-1-ol?
2-(2-amino-5-fluoro-6-methylbenzimidazol-1-yl)cyclohexan-1-ol has a molecular weight of 263.32 g/mol, XLogP of 2.54, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-amino-5-fluoro-6-methylbenzimidazol-1-yl)cyclohexan-1-ol is sourced from PubChem (CID 103592912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).