1-(6-fluoro-8,10-dimethyl-1,2,3,5,6,11c-hexahydroindolizino[7,8-b]indol-7-yl)-2-pyridin-3-ylpropan-2-ol

C24H28FN3O — CID 73296307

IUPAC1-(6-fluoro-8,10-dimethyl-1,2,3,5,6,11c-hexahydroindolizino[7,8-b]indol-7-yl)-2-pyridin-3-ylpropan-2-ol
SMILESCc1cc(C)c2c(c1)c1c(n2CC(C)(O)c2cccnc2)C(F)CN2CCCC12
InChIInChI=1S/C24H28FN3O/c1-15-10-16(2)22-18(11-15)21-20-7-5-9-27(20)13-19(25)23(21)28(22)14-24(3,29)17-6-4-8-26-12-17/h4,6,8,10-12,19-20,29H,5,7,9,13-14H2,1-3H3
InChIKeyVJWWXCKNWXEYGC-UHFFFAOYSA-N
MW393.51 g/mol
LogP4.72
Rot. Bonds3

About 1-(6-fluoro-8,10-dimethyl-1,2,3,5,6,11c-hexahydroindolizino[7,8-b]indol-7-yl)-2-pyridin-3-ylpropan-2-ol

1-(6-fluoro-8,10-dimethyl-1,2,3,5,6,11c-hexahydroindolizino[7,8-b]indol-7-yl)-2-pyridin-3-ylpropan-2-ol (PubChem CID 73296307) has the molecular formula C24H28FN3O and a molecular weight of 393.51 g/mol. Its IUPAC name is 1-(6-fluoro-8,10-dimethyl-1,2,3,5,6,11c-hexahydroindolizino[7,8-b]indol-7-yl)-2-pyridin-3-ylpropan-2-ol.

Molecular Properties

Compound Name1-(6-fluoro-8,10-dimethyl-1,2,3,5,6,11c-hexahydroindolizino[7,8-b]indol-7-yl)-2-pyridin-3-ylpropan-2-ol
PubChem CID73296307
Molecular FormulaC24H28FN3O
Molecular Weight393.51 g/mol
Exact Mass393.22
IUPAC Name1-(6-fluoro-8,10-dimethyl-1,2,3,5,6,11c-hexahydroindolizino[7,8-b]indol-7-yl)-2-pyridin-3-ylpropan-2-ol
SMILESCc1cc(C)c2c(c1)c1c(n2CC(C)(O)c2cccnc2)C(F)CN2CCCC12
InChIInChI=1S/C24H28FN3O/c1-15-10-16(2)22-18(11-15)21-20-7-5-9-27(20)13-19(25)23(21)28(22)14-24(3,29)17-6-4-8-26-12-17/h4,6,8,10-12,19-20,29H,5,7,9,13-14H2,1-3H3
InChIKeyVJWWXCKNWXEYGC-UHFFFAOYSA-N
XLogP4.72
TPSA41.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500393.51
LogP ≤ 54.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-(6-fluoro-8,10-dimethyl-1,2,3,5,6,11c-hexahydroindolizino[7,8-b]indol-7-yl)-2-pyridin-3-ylpropan-2-ol 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 1-(6-fluoro-8,10-dimethyl-1,2,3,5,6,11c-hexahydroindolizino[7,8-b]indol-7-yl)-2-pyridin-3-ylpropan-2-ol?
The IUPAC name of 1-(6-fluoro-8,10-dimethyl-1,2,3,5,6,11c-hexahydroindolizino[7,8-b]indol-7-yl)-2-pyridin-3-ylpropan-2-ol (CID 73296307) is 1-(6-fluoro-8,10-dimethyl-1,2,3,5,6,11c-hexahydroindolizino[7,8-b]indol-7-yl)-2-pyridin-3-ylpropan-2-ol.
What is the SMILES notation for 1-(6-fluoro-8,10-dimethyl-1,2,3,5,6,11c-hexahydroindolizino[7,8-b]indol-7-yl)-2-pyridin-3-ylpropan-2-ol?
The canonical SMILES for 1-(6-fluoro-8,10-dimethyl-1,2,3,5,6,11c-hexahydroindolizino[7,8-b]indol-7-yl)-2-pyridin-3-ylpropan-2-ol is Cc1cc(C)c2c(c1)c1c(n2CC(C)(O)c2cccnc2)C(F)CN2CCCC12.
What is the InChIKey of 1-(6-fluoro-8,10-dimethyl-1,2,3,5,6,11c-hexahydroindolizino[7,8-b]indol-7-yl)-2-pyridin-3-ylpropan-2-ol?
The InChIKey is VJWWXCKNWXEYGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28FN3O/c1-15-10-16(2)22-18(11-15)21-20-7-5-9-27(20)13-19(25)23(21)28(22)14-24(3,29)17-6-4-8-26-12-17/h4,6,8,10-12,19-20,29H,5,7,9,13-14H2,1-3H3.
What are the key properties of 1-(6-fluoro-8,10-dimethyl-1,2,3,5,6,11c-hexahydroindolizino[7,8-b]indol-7-yl)-2-pyridin-3-ylpropan-2-ol?
1-(6-fluoro-8,10-dimethyl-1,2,3,5,6,11c-hexahydroindolizino[7,8-b]indol-7-yl)-2-pyridin-3-ylpropan-2-ol has a molecular weight of 393.51 g/mol, XLogP of 4.72, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-fluoro-8,10-dimethyl-1,2,3,5,6,11c-hexahydroindolizino[7,8-b]indol-7-yl)-2-pyridin-3-ylpropan-2-ol is sourced from PubChem (CID 73296307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).