1-carbazol-9-yl-3-(2-methylbenzimidazol-1-yl)propan-2-ol

C23H21N3O — CID 2855383

IUPAC1-carbazol-9-yl-3-(2-methylbenzimidazol-1-yl)propan-2-ol
SMILESCc1nc2ccccc2n1CC(O)Cn1c2ccccc2c2ccccc21
InChIInChI=1S/C23H21N3O/c1-16-24-20-10-4-7-13-23(20)25(16)14-17(27)15-26-21-11-5-2-8-18(21)19-9-3-6-12-22(19)26/h2-13,17,27H,14-15H2,1H3
InChIKeyJPPYNSLIOBRLRO-UHFFFAOYSA-N
MW355.44 g/mol
LogP4.51
Rot. Bonds4

About 1-carbazol-9-yl-3-(2-methylbenzimidazol-1-yl)propan-2-ol

1-carbazol-9-yl-3-(2-methylbenzimidazol-1-yl)propan-2-ol (PubChem CID 2855383) has the molecular formula C23H21N3O and a molecular weight of 355.44 g/mol. Its IUPAC name is 1-carbazol-9-yl-3-(2-methylbenzimidazol-1-yl)propan-2-ol.

Molecular Properties

Compound Name1-carbazol-9-yl-3-(2-methylbenzimidazol-1-yl)propan-2-ol
PubChem CID2855383
Molecular FormulaC23H21N3O
Molecular Weight355.44 g/mol
Exact Mass355.17
IUPAC Name1-carbazol-9-yl-3-(2-methylbenzimidazol-1-yl)propan-2-ol
SMILESCc1nc2ccccc2n1CC(O)Cn1c2ccccc2c2ccccc21
InChIInChI=1S/C23H21N3O/c1-16-24-20-10-4-7-13-23(20)25(16)14-17(27)15-26-21-11-5-2-8-18(21)19-9-3-6-12-22(19)26/h2-13,17,27H,14-15H2,1H3
InChIKeyJPPYNSLIOBRLRO-UHFFFAOYSA-N
XLogP4.51
TPSA42.98 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.44
LogP ≤ 54.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-carbazol-9-yl-3-(2-methylbenzimidazol-1-yl)propan-2-ol?
The IUPAC name of 1-carbazol-9-yl-3-(2-methylbenzimidazol-1-yl)propan-2-ol (CID 2855383) is 1-carbazol-9-yl-3-(2-methylbenzimidazol-1-yl)propan-2-ol.
What is the SMILES notation for 1-carbazol-9-yl-3-(2-methylbenzimidazol-1-yl)propan-2-ol?
The canonical SMILES for 1-carbazol-9-yl-3-(2-methylbenzimidazol-1-yl)propan-2-ol is Cc1nc2ccccc2n1CC(O)Cn1c2ccccc2c2ccccc21.
What is the InChIKey of 1-carbazol-9-yl-3-(2-methylbenzimidazol-1-yl)propan-2-ol?
The InChIKey is JPPYNSLIOBRLRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21N3O/c1-16-24-20-10-4-7-13-23(20)25(16)14-17(27)15-26-21-11-5-2-8-18(21)19-9-3-6-12-22(19)26/h2-13,17,27H,14-15H2,1H3.
What are the key properties of 1-carbazol-9-yl-3-(2-methylbenzimidazol-1-yl)propan-2-ol?
1-carbazol-9-yl-3-(2-methylbenzimidazol-1-yl)propan-2-ol has a molecular weight of 355.44 g/mol, XLogP of 4.51, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-carbazol-9-yl-3-(2-methylbenzimidazol-1-yl)propan-2-ol is sourced from PubChem (CID 2855383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).