1-carbazol-9-yl-3-(4-pyridin-2-ylpiperazin-1-yl)propan-2-ol

C24H26N4O — CID 655222

IUPAC1-carbazol-9-yl-3-(4-pyridin-2-ylpiperazin-1-yl)propan-2-ol
SMILESOC(CN1CCN(c2ccccn2)CC1)Cn1c2ccccc2c2ccccc21
InChIInChI=1S/C24H26N4O/c29-19(17-26-13-15-27(16-14-26)24-11-5-6-12-25-24)18-28-22-9-3-1-7-20(22)21-8-2-4-10-23(21)28/h1-12,19,29H,13-18H2
InChIKeyVXQCFYVSUXZUTE-UHFFFAOYSA-N
MW386.50 g/mol
LogP3.37
Rot. Bonds5

About 1-carbazol-9-yl-3-(4-pyridin-2-ylpiperazin-1-yl)propan-2-ol

1-carbazol-9-yl-3-(4-pyridin-2-ylpiperazin-1-yl)propan-2-ol (PubChem CID 655222) has the molecular formula C24H26N4O and a molecular weight of 386.50 g/mol. Its IUPAC name is 1-carbazol-9-yl-3-(4-pyridin-2-ylpiperazin-1-yl)propan-2-ol.

Molecular Properties

Compound Name1-carbazol-9-yl-3-(4-pyridin-2-ylpiperazin-1-yl)propan-2-ol
PubChem CID655222
Molecular FormulaC24H26N4O
Molecular Weight386.50 g/mol
Exact Mass386.21
IUPAC Name1-carbazol-9-yl-3-(4-pyridin-2-ylpiperazin-1-yl)propan-2-ol
SMILESOC(CN1CCN(c2ccccn2)CC1)Cn1c2ccccc2c2ccccc21
InChIInChI=1S/C24H26N4O/c29-19(17-26-13-15-27(16-14-26)24-11-5-6-12-25-24)18-28-22-9-3-1-7-20(22)21-8-2-4-10-23(21)28/h1-12,19,29H,13-18H2
InChIKeyVXQCFYVSUXZUTE-UHFFFAOYSA-N
XLogP3.37
TPSA44.53 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms29
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.50
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-carbazol-9-yl-3-(4-pyridin-2-ylpiperazin-1-yl)propan-2-ol?
The IUPAC name of 1-carbazol-9-yl-3-(4-pyridin-2-ylpiperazin-1-yl)propan-2-ol (CID 655222) is 1-carbazol-9-yl-3-(4-pyridin-2-ylpiperazin-1-yl)propan-2-ol.
What is the SMILES notation for 1-carbazol-9-yl-3-(4-pyridin-2-ylpiperazin-1-yl)propan-2-ol?
The canonical SMILES for 1-carbazol-9-yl-3-(4-pyridin-2-ylpiperazin-1-yl)propan-2-ol is OC(CN1CCN(c2ccccn2)CC1)Cn1c2ccccc2c2ccccc21.
What is the InChIKey of 1-carbazol-9-yl-3-(4-pyridin-2-ylpiperazin-1-yl)propan-2-ol?
The InChIKey is VXQCFYVSUXZUTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N4O/c29-19(17-26-13-15-27(16-14-26)24-11-5-6-12-25-24)18-28-22-9-3-1-7-20(22)21-8-2-4-10-23(21)28/h1-12,19,29H,13-18H2.
What are the key properties of 1-carbazol-9-yl-3-(4-pyridin-2-ylpiperazin-1-yl)propan-2-ol?
1-carbazol-9-yl-3-(4-pyridin-2-ylpiperazin-1-yl)propan-2-ol has a molecular weight of 386.50 g/mol, XLogP of 3.37, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-carbazol-9-yl-3-(4-pyridin-2-ylpiperazin-1-yl)propan-2-ol is sourced from PubChem (CID 655222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).