4-(piperidin-4-ylidenemethyl)-1-propan-2-yl-2,3-dihydroindole

C17H24N2 — CID 167254012

IUPAC4-(piperidin-4-ylidenemethyl)-1-propan-2-yl-2,3-dihydroindole
SMILESCC(C)N1CCc2c(C=C3CCNCC3)cccc21
InChIInChI=1S/C17H24N2/c1-13(2)19-11-8-16-15(4-3-5-17(16)19)12-14-6-9-18-10-7-14/h3-5,12-13,18H,6-11H2,1-2H3
InChIKeyWGZJVFHSRCDXQJ-UHFFFAOYSA-N
MW256.39 g/mol
LogP3.22
Rot. Bonds2

About 4-(piperidin-4-ylidenemethyl)-1-propan-2-yl-2,3-dihydroindole

4-(piperidin-4-ylidenemethyl)-1-propan-2-yl-2,3-dihydroindole (PubChem CID 167254012) has the molecular formula C17H24N2 and a molecular weight of 256.39 g/mol. Its IUPAC name is 4-(piperidin-4-ylidenemethyl)-1-propan-2-yl-2,3-dihydroindole.

Molecular Properties

Compound Name4-(piperidin-4-ylidenemethyl)-1-propan-2-yl-2,3-dihydroindole
PubChem CID167254012
Molecular FormulaC17H24N2
Molecular Weight256.39 g/mol
Exact Mass256.19
IUPAC Name4-(piperidin-4-ylidenemethyl)-1-propan-2-yl-2,3-dihydroindole
SMILESCC(C)N1CCc2c(C=C3CCNCC3)cccc21
InChIInChI=1S/C17H24N2/c1-13(2)19-11-8-16-15(4-3-5-17(16)19)12-14-6-9-18-10-7-14/h3-5,12-13,18H,6-11H2,1-2H3
InChIKeyWGZJVFHSRCDXQJ-UHFFFAOYSA-N
XLogP3.22
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 4-(piperidin-4-ylidenemethyl)-1-propan-2-yl-2,3-dihydroindole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(1-propan-2-yl-2,3-dihydroindol-4-yl)methanol
CID 115114810
1-propan-2-yl-4-pyridin-2-yl-2,3-dihydroindole
CID 176629407
1-methanidyl-4-(piperidin-4-ylidenemethyl)-2,3-dihydro-1H-indol-1-ium
CID 166017076
4-[(2,3-dichlorophenyl)methylidene]piperidine
CID 107310997
5-chloro-1-propan-2-yl-3,4-dihydro-2H-quinoline
CID 121382679
4-[(3-chloro-2-fluorophenyl)methylidene]piperidine
CID 102864225
2-(piperidin-4-ylidenemethyl)benzoic acid
CID 167976622
CID 174030849
CID 174030849
1-(1-piperidin-4-ylethyl)-2,3-dihydroindole
CID 105488726
1-butan-2-yl-4-chloro-2,3-dihydroindole
CID 70850462
1-propan-2-yl-3,4-dihydro-2H-quinoxalin-5-amine
CID 115095772
1-propan-2-yl-6-tritio-2,3-dihydroindole
CID 166586860

Frequently Asked Questions

What is the IUPAC name of 4-(piperidin-4-ylidenemethyl)-1-propan-2-yl-2,3-dihydroindole?
The IUPAC name of 4-(piperidin-4-ylidenemethyl)-1-propan-2-yl-2,3-dihydroindole (CID 167254012) is 4-(piperidin-4-ylidenemethyl)-1-propan-2-yl-2,3-dihydroindole.
What is the SMILES notation for 4-(piperidin-4-ylidenemethyl)-1-propan-2-yl-2,3-dihydroindole?
The canonical SMILES for 4-(piperidin-4-ylidenemethyl)-1-propan-2-yl-2,3-dihydroindole is CC(C)N1CCc2c(C=C3CCNCC3)cccc21.
What is the InChIKey of 4-(piperidin-4-ylidenemethyl)-1-propan-2-yl-2,3-dihydroindole?
The InChIKey is WGZJVFHSRCDXQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2/c1-13(2)19-11-8-16-15(4-3-5-17(16)19)12-14-6-9-18-10-7-14/h3-5,12-13,18H,6-11H2,1-2H3.
What are the key properties of 4-(piperidin-4-ylidenemethyl)-1-propan-2-yl-2,3-dihydroindole?
4-(piperidin-4-ylidenemethyl)-1-propan-2-yl-2,3-dihydroindole has a molecular weight of 256.39 g/mol, XLogP of 3.22, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(piperidin-4-ylidenemethyl)-1-propan-2-yl-2,3-dihydroindole is sourced from PubChem (CID 167254012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).