2-amino-1-(2-methylphenyl)benzimidazol-5-ol

C14H13N3O — CID 84799586

IUPAC2-amino-1-(2-methylphenyl)benzimidazol-5-ol
SMILESCc1ccccc1-n1c(N)nc2cc(O)ccc21
InChIInChI=1S/C14H13N3O/c1-9-4-2-3-5-12(9)17-13-7-6-10(18)8-11(13)16-14(17)15/h2-8,18H,1H3,(H2,15,16)
InChIKeyCKIXYMOEQSKWND-UHFFFAOYSA-N
MW239.28 g/mol
LogP2.62
Rot. Bonds1

About 2-amino-1-(2-methylphenyl)benzimidazol-5-ol

2-amino-1-(2-methylphenyl)benzimidazol-5-ol (PubChem CID 84799586) has the molecular formula C14H13N3O and a molecular weight of 239.28 g/mol. Its IUPAC name is 2-amino-1-(2-methylphenyl)benzimidazol-5-ol.

Molecular Properties

Compound Name2-amino-1-(2-methylphenyl)benzimidazol-5-ol
PubChem CID84799586
Molecular FormulaC14H13N3O
Molecular Weight239.28 g/mol
Exact Mass239.11
IUPAC Name2-amino-1-(2-methylphenyl)benzimidazol-5-ol
SMILESCc1ccccc1-n1c(N)nc2cc(O)ccc21
InChIInChI=1S/C14H13N3O/c1-9-4-2-3-5-12(9)17-13-7-6-10(18)8-11(13)16-14(17)15/h2-8,18H,1H3,(H2,15,16)
InChIKeyCKIXYMOEQSKWND-UHFFFAOYSA-N
XLogP2.62
TPSA64.07 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.28
LogP ≤ 52.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-methyl-1-(2-methylphenyl)benzimidazol-2-amine
CID 43661880
2-(2-aminobenzimidazol-1-yl)-4,6-dimethylphenol
CID 164618376
6-chloro-1-(2-methylphenyl)benzimidazol-2-amine
CID 115470391
1-(2-iodophenyl)-5-methylbenzimidazol-2-amine
CID 43661748
3-(2-amino-5-methylbenzimidazol-1-yl)phenol
CID 84799591
3-methyl-4-[2-(2-methylphenyl)benzimidazol-1-yl]phenol
CID 57424050
7-hydroxy-2-methyl-3-(2-methylphenyl)quinazolin-4-one
CID 5377276
5-methyl-3-(2-methylphenyl)imidazo[4,5-b]pyridin-2-amine
CID 81138231
3-(2-aminobenzimidazol-1-yl)-4-methylbenzonitrile
CID 62104310
2-[3,5-bis[1-(2-methylphenyl)benzimidazol-2-yl]phenyl]-1-(2-methylphenyl)benzimidazole
CID 23399455
1-(2-methylphenyl)imidazo[4,5-b]pyridin-2-amine
CID 54098498
5-chloro-1-(2-methoxyphenyl)benzimidazol-2-amine
CID 43659394

Frequently Asked Questions

What is the IUPAC name of 2-amino-1-(2-methylphenyl)benzimidazol-5-ol?
The IUPAC name of 2-amino-1-(2-methylphenyl)benzimidazol-5-ol (CID 84799586) is 2-amino-1-(2-methylphenyl)benzimidazol-5-ol.
What is the SMILES notation for 2-amino-1-(2-methylphenyl)benzimidazol-5-ol?
The canonical SMILES for 2-amino-1-(2-methylphenyl)benzimidazol-5-ol is Cc1ccccc1-n1c(N)nc2cc(O)ccc21.
What is the InChIKey of 2-amino-1-(2-methylphenyl)benzimidazol-5-ol?
The InChIKey is CKIXYMOEQSKWND-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N3O/c1-9-4-2-3-5-12(9)17-13-7-6-10(18)8-11(13)16-14(17)15/h2-8,18H,1H3,(H2,15,16).
What are the key properties of 2-amino-1-(2-methylphenyl)benzimidazol-5-ol?
2-amino-1-(2-methylphenyl)benzimidazol-5-ol has a molecular weight of 239.28 g/mol, XLogP of 2.62, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-(2-methylphenyl)benzimidazol-5-ol is sourced from PubChem (CID 84799586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).