1-carbazol-9-yl-3-quinolin-8-yloxypropan-2-ol

C24H20N2O2 — CID 3124281

IUPAC1-carbazol-9-yl-3-quinolin-8-yloxypropan-2-ol
SMILESOC(COc1cccc2cccnc12)Cn1c2ccccc2c2ccccc21
InChIInChI=1S/C24H20N2O2/c27-18(16-28-23-13-5-7-17-8-6-14-25-24(17)23)15-26-21-11-3-1-9-19(21)20-10-2-4-12-22(20)26/h1-14,18,27H,15-16H2
InChIKeyIHTNCHFQXFIPGF-UHFFFAOYSA-N
MW368.44 g/mol
LogP4.78
Rot. Bonds5

About 1-carbazol-9-yl-3-quinolin-8-yloxypropan-2-ol

1-carbazol-9-yl-3-quinolin-8-yloxypropan-2-ol (PubChem CID 3124281) has the molecular formula C24H20N2O2 and a molecular weight of 368.44 g/mol. Its IUPAC name is 1-carbazol-9-yl-3-quinolin-8-yloxypropan-2-ol.

Molecular Properties

Compound Name1-carbazol-9-yl-3-quinolin-8-yloxypropan-2-ol
PubChem CID3124281
Molecular FormulaC24H20N2O2
Molecular Weight368.44 g/mol
Exact Mass368.15
IUPAC Name1-carbazol-9-yl-3-quinolin-8-yloxypropan-2-ol
SMILESOC(COc1cccc2cccnc12)Cn1c2ccccc2c2ccccc21
InChIInChI=1S/C24H20N2O2/c27-18(16-28-23-13-5-7-17-8-6-14-25-24(17)23)15-26-21-11-3-1-9-19(21)20-10-2-4-12-22(20)26/h1-14,18,27H,15-16H2
InChIKeyIHTNCHFQXFIPGF-UHFFFAOYSA-N
XLogP4.78
TPSA47.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.44
LogP ≤ 54.78
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-quinolin-8-yloxypropan-2-ol?
The IUPAC name of 1-carbazol-9-yl-3-quinolin-8-yloxypropan-2-ol (CID 3124281) is 1-carbazol-9-yl-3-quinolin-8-yloxypropan-2-ol.
What is the SMILES notation for 1-carbazol-9-yl-3-quinolin-8-yloxypropan-2-ol?
The canonical SMILES for 1-carbazol-9-yl-3-quinolin-8-yloxypropan-2-ol is OC(COc1cccc2cccnc12)Cn1c2ccccc2c2ccccc21.
What is the InChIKey of 1-carbazol-9-yl-3-quinolin-8-yloxypropan-2-ol?
The InChIKey is IHTNCHFQXFIPGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20N2O2/c27-18(16-28-23-13-5-7-17-8-6-14-25-24(17)23)15-26-21-11-3-1-9-19(21)20-10-2-4-12-22(20)26/h1-14,18,27H,15-16H2.
What are the key properties of 1-carbazol-9-yl-3-quinolin-8-yloxypropan-2-ol?
1-carbazol-9-yl-3-quinolin-8-yloxypropan-2-ol has a molecular weight of 368.44 g/mol, XLogP of 4.78, 5 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-quinolin-8-yloxypropan-2-ol is sourced from PubChem (CID 3124281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).