1-pyridin-4-yl-2-(6,6,10-trimethyl-2,3,5,11c-tetrahydro-1H-indolizino[7,8-b]indol-7-yl)ethanol

C24H29N3O — CID 73296593

IUPAC1-pyridin-4-yl-2-(6,6,10-trimethyl-2,3,5,11c-tetrahydro-1H-indolizino[7,8-b]indol-7-yl)ethanol
SMILESCc1ccc2c(c1)c1c(n2CC(O)c2ccncc2)C(C)(C)CN2CCCC12
InChIInChI=1S/C24H29N3O/c1-16-6-7-19-18(13-16)22-20-5-4-12-26(20)15-24(2,3)23(22)27(19)14-21(28)17-8-10-25-11-9-17/h6-11,13,20-21,28H,4-5,12,14-15H2,1-3H3
InChIKeyLGGXEXLPKKMGQR-UHFFFAOYSA-N
MW375.52 g/mol
LogP4.51
Rot. Bonds3

About 1-pyridin-4-yl-2-(6,6,10-trimethyl-2,3,5,11c-tetrahydro-1H-indolizino[7,8-b]indol-7-yl)ethanol

1-pyridin-4-yl-2-(6,6,10-trimethyl-2,3,5,11c-tetrahydro-1H-indolizino[7,8-b]indol-7-yl)ethanol (PubChem CID 73296593) has the molecular formula C24H29N3O and a molecular weight of 375.52 g/mol. Its IUPAC name is 1-pyridin-4-yl-2-(6,6,10-trimethyl-2,3,5,11c-tetrahydro-1H-indolizino[7,8-b]indol-7-yl)ethanol.

Molecular Properties

Compound Name1-pyridin-4-yl-2-(6,6,10-trimethyl-2,3,5,11c-tetrahydro-1H-indolizino[7,8-b]indol-7-yl)ethanol
PubChem CID73296593
Molecular FormulaC24H29N3O
Molecular Weight375.52 g/mol
Exact Mass375.23
IUPAC Name1-pyridin-4-yl-2-(6,6,10-trimethyl-2,3,5,11c-tetrahydro-1H-indolizino[7,8-b]indol-7-yl)ethanol
SMILESCc1ccc2c(c1)c1c(n2CC(O)c2ccncc2)C(C)(C)CN2CCCC12
InChIInChI=1S/C24H29N3O/c1-16-6-7-19-18(13-16)22-20-5-4-12-26(20)15-24(2,3)23(22)27(19)14-21(28)17-8-10-25-11-9-17/h6-11,13,20-21,28H,4-5,12,14-15H2,1-3H3
InChIKeyLGGXEXLPKKMGQR-UHFFFAOYSA-N
XLogP4.51
TPSA41.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.52
LogP ≤ 54.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-pyridin-4-yl-2-(6,6,10-trimethyl-2,3,5,11c-tetrahydro-1H-indolizino[7,8-b]indol-7-yl)ethanol 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-pyridin-4-yl-2-(6,6,10-trimethyl-2,3,5,11c-tetrahydro-1H-indolizino[7,8-b]indol-7-yl)ethanol?
The IUPAC name of 1-pyridin-4-yl-2-(6,6,10-trimethyl-2,3,5,11c-tetrahydro-1H-indolizino[7,8-b]indol-7-yl)ethanol (CID 73296593) is 1-pyridin-4-yl-2-(6,6,10-trimethyl-2,3,5,11c-tetrahydro-1H-indolizino[7,8-b]indol-7-yl)ethanol.
What is the SMILES notation for 1-pyridin-4-yl-2-(6,6,10-trimethyl-2,3,5,11c-tetrahydro-1H-indolizino[7,8-b]indol-7-yl)ethanol?
The canonical SMILES for 1-pyridin-4-yl-2-(6,6,10-trimethyl-2,3,5,11c-tetrahydro-1H-indolizino[7,8-b]indol-7-yl)ethanol is Cc1ccc2c(c1)c1c(n2CC(O)c2ccncc2)C(C)(C)CN2CCCC12.
What is the InChIKey of 1-pyridin-4-yl-2-(6,6,10-trimethyl-2,3,5,11c-tetrahydro-1H-indolizino[7,8-b]indol-7-yl)ethanol?
The InChIKey is LGGXEXLPKKMGQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H29N3O/c1-16-6-7-19-18(13-16)22-20-5-4-12-26(20)15-24(2,3)23(22)27(19)14-21(28)17-8-10-25-11-9-17/h6-11,13,20-21,28H,4-5,12,14-15H2,1-3H3.
What are the key properties of 1-pyridin-4-yl-2-(6,6,10-trimethyl-2,3,5,11c-tetrahydro-1H-indolizino[7,8-b]indol-7-yl)ethanol?
1-pyridin-4-yl-2-(6,6,10-trimethyl-2,3,5,11c-tetrahydro-1H-indolizino[7,8-b]indol-7-yl)ethanol has a molecular weight of 375.52 g/mol, XLogP of 4.51, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-pyridin-4-yl-2-(6,6,10-trimethyl-2,3,5,11c-tetrahydro-1H-indolizino[7,8-b]indol-7-yl)ethanol is sourced from PubChem (CID 73296593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).