3-(2-methylimidazo[1,2-a]benzimidazol-3-yl)propan-1-ol

C13H15N3O — CID 6624969

IUPAC3-(2-methylimidazo[1,2-a]benzimidazol-3-yl)propan-1-ol
SMILESCc1cn2c3ccccc3nc2n1CCCO
InChIInChI=1S/C13H15N3O/c1-10-9-16-12-6-3-2-5-11(12)14-13(16)15(10)7-4-8-17/h2-3,5-6,9,17H,4,7-8H2,1H3
InChIKeyPCWDHVNLAPVIJW-UHFFFAOYSA-N
MW229.28 g/mol
LogP1.98
Rot. Bonds3

About 3-(2-methylimidazo[1,2-a]benzimidazol-3-yl)propan-1-ol

3-(2-methylimidazo[1,2-a]benzimidazol-3-yl)propan-1-ol (PubChem CID 6624969) has the molecular formula C13H15N3O and a molecular weight of 229.28 g/mol. Its IUPAC name is 3-(2-methylimidazo[1,2-a]benzimidazol-3-yl)propan-1-ol.

Molecular Properties

Compound Name3-(2-methylimidazo[1,2-a]benzimidazol-3-yl)propan-1-ol
PubChem CID6624969
Molecular FormulaC13H15N3O
Molecular Weight229.28 g/mol
Exact Mass229.12
IUPAC Name3-(2-methylimidazo[1,2-a]benzimidazol-3-yl)propan-1-ol
SMILESCc1cn2c3ccccc3nc2n1CCCO
InChIInChI=1S/C13H15N3O/c1-10-9-16-12-6-3-2-5-11(12)14-13(16)15(10)7-4-8-17/h2-3,5-6,9,17H,4,7-8H2,1H3
InChIKeyPCWDHVNLAPVIJW-UHFFFAOYSA-N
XLogP1.98
TPSA42.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.28
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-[2-(methylamino)benzimidazol-1-yl]propan-1-ol
CID 82359483
3-[2-[1-(dimethylamino)ethyl]benzimidazol-1-yl]propan-1-ol
CID 82311877
3-(2-butylbenzimidazol-1-yl)propan-1-ol
CID 82149501
3-(1-methylbenzimidazol-2-yl)propan-1-ol
CID 4585215
2-(2-methylbenzimidazol-1-yl)ethanol
CID 761926
diethyl-[3-[2-(4-methylphenyl)imidazo[1,2-a]benzimidazol-3-yl]propyl]azanium
CID 6985044
2-[2-(4-bromophenyl)imidazo[1,2-a]benzimidazol-3-yl]ethanol
CID 1068607
3-[2-(3-chlorophenyl)benzimidazol-1-yl]propan-1-ol
CID 82149518
2-(4-chlorophenyl)-3-(3-chloropropyl)imidazo[1,2-a]benzimidazole
CID 3374476
3-[2-[(dipropylamino)methyl]benzimidazol-1-yl]propan-1-ol
CID 82311798
3-[2-[1-[butyl(methyl)amino]ethyl]benzimidazol-1-yl]propan-1-ol
CID 82311878
3-(2-tert-butylimidazo[1,2-a]benzimidazol-3-yl)propyl-propan-2-ylazanium
CID 7390394

Frequently Asked Questions

What is the IUPAC name of 3-(2-methylimidazo[1,2-a]benzimidazol-3-yl)propan-1-ol?
The IUPAC name of 3-(2-methylimidazo[1,2-a]benzimidazol-3-yl)propan-1-ol (CID 6624969) is 3-(2-methylimidazo[1,2-a]benzimidazol-3-yl)propan-1-ol.
What is the SMILES notation for 3-(2-methylimidazo[1,2-a]benzimidazol-3-yl)propan-1-ol?
The canonical SMILES for 3-(2-methylimidazo[1,2-a]benzimidazol-3-yl)propan-1-ol is Cc1cn2c3ccccc3nc2n1CCCO.
What is the InChIKey of 3-(2-methylimidazo[1,2-a]benzimidazol-3-yl)propan-1-ol?
The InChIKey is PCWDHVNLAPVIJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O/c1-10-9-16-12-6-3-2-5-11(12)14-13(16)15(10)7-4-8-17/h2-3,5-6,9,17H,4,7-8H2,1H3.
What are the key properties of 3-(2-methylimidazo[1,2-a]benzimidazol-3-yl)propan-1-ol?
3-(2-methylimidazo[1,2-a]benzimidazol-3-yl)propan-1-ol has a molecular weight of 229.28 g/mol, XLogP of 1.98, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methylimidazo[1,2-a]benzimidazol-3-yl)propan-1-ol is sourced from PubChem (CID 6624969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).