1-[3-(3H-inden-1-yl)propyl]-3,3-dimethylpiperidine

C19H27N — CID 10686061

IUPAC1-[3-(3H-inden-1-yl)propyl]-3,3-dimethylpiperidine
SMILESCC1(C)CCCN(CCCC2=CCc3ccccc32)C1
InChIInChI=1S/C19H27N/c1-19(2)12-6-14-20(15-19)13-5-8-17-11-10-16-7-3-4-9-18(16)17/h3-4,7,9,11H,5-6,8,10,12-15H2,1-2H3
InChIKeyKAFCLZVKMJZLJA-UHFFFAOYSA-N
MW269.43 g/mol
LogP4.53
Rot. Bonds4

About 1-[3-(3H-inden-1-yl)propyl]-3,3-dimethylpiperidine

1-[3-(3H-inden-1-yl)propyl]-3,3-dimethylpiperidine (PubChem CID 10686061) has the molecular formula C19H27N and a molecular weight of 269.43 g/mol. Its IUPAC name is 1-[3-(3H-inden-1-yl)propyl]-3,3-dimethylpiperidine.

Molecular Properties

Compound Name1-[3-(3H-inden-1-yl)propyl]-3,3-dimethylpiperidine
PubChem CID10686061
Molecular FormulaC19H27N
Molecular Weight269.43 g/mol
Exact Mass269.21
IUPAC Name1-[3-(3H-inden-1-yl)propyl]-3,3-dimethylpiperidine
SMILESCC1(C)CCCN(CCCC2=CCc3ccccc32)C1
InChIInChI=1S/C19H27N/c1-19(2)12-6-14-20(15-19)13-5-8-17-11-10-16-7-3-4-9-18(16)17/h3-4,7,9,11H,5-6,8,10,12-15H2,1-2H3
InChIKeyKAFCLZVKMJZLJA-UHFFFAOYSA-N
XLogP4.53
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.43
LogP ≤ 54.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 1-[3-(3H-inden-1-yl)propyl]-3,3-dimethylpiperidine 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-[3-(3H-inden-1-yl)propyl]-3,3-dimethylpiperidine?
The IUPAC name of 1-[3-(3H-inden-1-yl)propyl]-3,3-dimethylpiperidine (CID 10686061) is 1-[3-(3H-inden-1-yl)propyl]-3,3-dimethylpiperidine.
What is the SMILES notation for 1-[3-(3H-inden-1-yl)propyl]-3,3-dimethylpiperidine?
The canonical SMILES for 1-[3-(3H-inden-1-yl)propyl]-3,3-dimethylpiperidine is CC1(C)CCCN(CCCC2=CCc3ccccc32)C1.
What is the InChIKey of 1-[3-(3H-inden-1-yl)propyl]-3,3-dimethylpiperidine?
The InChIKey is KAFCLZVKMJZLJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27N/c1-19(2)12-6-14-20(15-19)13-5-8-17-11-10-16-7-3-4-9-18(16)17/h3-4,7,9,11H,5-6,8,10,12-15H2,1-2H3.
What are the key properties of 1-[3-(3H-inden-1-yl)propyl]-3,3-dimethylpiperidine?
1-[3-(3H-inden-1-yl)propyl]-3,3-dimethylpiperidine has a molecular weight of 269.43 g/mol, XLogP of 4.53, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(3H-inden-1-yl)propyl]-3,3-dimethylpiperidine is sourced from PubChem (CID 10686061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).