2-[1-(6-amino-2-pyridinyl)-4-methylbenzimidazol-2-yl]ethanol

C15H16N4O — CID 50970553

IUPAC2-[1-(6-amino-2-pyridinyl)-4-methylbenzimidazol-2-yl]ethanol
SMILESCc1cccc2c1nc(CCO)n2-c1cccc(N)n1
InChIInChI=1S/C15H16N4O/c1-10-4-2-5-11-15(10)18-14(8-9-20)19(11)13-7-3-6-12(16)17-13/h2-7,20H,8-9H2,1H3,(H2,16,17)
InChIKeyXNUMPIAKSOTHAP-UHFFFAOYSA-N
MW268.32 g/mol
LogP1.85
Rot. Bonds3

About 2-[1-(6-amino-2-pyridinyl)-4-methylbenzimidazol-2-yl]ethanol

2-[1-(6-amino-2-pyridinyl)-4-methylbenzimidazol-2-yl]ethanol (PubChem CID 50970553) has the molecular formula C15H16N4O and a molecular weight of 268.32 g/mol. Its IUPAC name is 2-[1-(6-amino-2-pyridinyl)-4-methylbenzimidazol-2-yl]ethanol.

Molecular Properties

Compound Name2-[1-(6-amino-2-pyridinyl)-4-methylbenzimidazol-2-yl]ethanol
PubChem CID50970553
Molecular FormulaC15H16N4O
Molecular Weight268.32 g/mol
Exact Mass268.13
IUPAC Name2-[1-(6-amino-2-pyridinyl)-4-methylbenzimidazol-2-yl]ethanol
SMILESCc1cccc2c1nc(CCO)n2-c1cccc(N)n1
InChIInChI=1S/C15H16N4O/c1-10-4-2-5-11-15(10)18-14(8-9-20)19(11)13-7-3-6-12(16)17-13/h2-7,20H,8-9H2,1H3,(H2,16,17)
InChIKeyXNUMPIAKSOTHAP-UHFFFAOYSA-N
XLogP1.85
TPSA76.96 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 51.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-[1-(6-amino-2-pyridinyl)-4-methylbenzimidazol-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

Frequently Asked Questions

What is the IUPAC name of 2-[1-(6-amino-2-pyridinyl)-4-methylbenzimidazol-2-yl]ethanol?
The IUPAC name of 2-[1-(6-amino-2-pyridinyl)-4-methylbenzimidazol-2-yl]ethanol (CID 50970553) is 2-[1-(6-amino-2-pyridinyl)-4-methylbenzimidazol-2-yl]ethanol.
What is the SMILES notation for 2-[1-(6-amino-2-pyridinyl)-4-methylbenzimidazol-2-yl]ethanol?
The canonical SMILES for 2-[1-(6-amino-2-pyridinyl)-4-methylbenzimidazol-2-yl]ethanol is Cc1cccc2c1nc(CCO)n2-c1cccc(N)n1.
What is the InChIKey of 2-[1-(6-amino-2-pyridinyl)-4-methylbenzimidazol-2-yl]ethanol?
The InChIKey is XNUMPIAKSOTHAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4O/c1-10-4-2-5-11-15(10)18-14(8-9-20)19(11)13-7-3-6-12(16)17-13/h2-7,20H,8-9H2,1H3,(H2,16,17).
What are the key properties of 2-[1-(6-amino-2-pyridinyl)-4-methylbenzimidazol-2-yl]ethanol?
2-[1-(6-amino-2-pyridinyl)-4-methylbenzimidazol-2-yl]ethanol has a molecular weight of 268.32 g/mol, XLogP of 1.85, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(6-amino-2-pyridinyl)-4-methylbenzimidazol-2-yl]ethanol is sourced from PubChem (CID 50970553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).