1'-(2-phenylethyl)spiro[2,3-dihydro-1H-naphthalene-4,4'-piperidine]

C22H27N — CID 15163144

IUPAC1'-(2-phenylethyl)spiro[2,3-dihydro-1H-naphthalene-4,4'-piperidine]
SMILESc1ccc(CCN2CCC3(CCCc4ccccc43)CC2)cc1
InChIInChI=1S/C22H27N/c1-2-7-19(8-3-1)12-16-23-17-14-22(15-18-23)13-6-10-20-9-4-5-11-21(20)22/h1-5,7-9,11H,6,10,12-18H2
InChIKeyWJAIIPYAGQTWCG-UHFFFAOYSA-N
MW305.46 g/mol
LogP4.60
Rot. Bonds3

About 1'-(2-phenylethyl)spiro[2,3-dihydro-1H-naphthalene-4,4'-piperidine]

1'-(2-phenylethyl)spiro[2,3-dihydro-1H-naphthalene-4,4'-piperidine] (PubChem CID 15163144) has the molecular formula C22H27N and a molecular weight of 305.46 g/mol. Its IUPAC name is 1'-(2-phenylethyl)spiro[2,3-dihydro-1H-naphthalene-4,4'-piperidine].

Molecular Properties

Compound Name1'-(2-phenylethyl)spiro[2,3-dihydro-1H-naphthalene-4,4'-piperidine]
PubChem CID15163144
Molecular FormulaC22H27N
Molecular Weight305.46 g/mol
Exact Mass305.21
IUPAC Name1'-(2-phenylethyl)spiro[2,3-dihydro-1H-naphthalene-4,4'-piperidine]
SMILESc1ccc(CCN2CCC3(CCCc4ccccc43)CC2)cc1
InChIInChI=1S/C22H27N/c1-2-7-19(8-3-1)12-16-23-17-14-22(15-18-23)13-6-10-20-9-4-5-11-21(20)22/h1-5,7-9,11H,6,10,12-18H2
InChIKeyWJAIIPYAGQTWCG-UHFFFAOYSA-N
XLogP4.60
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.46
LogP ≤ 54.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 1'-(2-phenylethyl)spiro[2,3-dihydro-1H-naphthalene-4,4'-piperidine] 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'-(2-phenylethyl)spiro[2,3-dihydro-1H-naphthalene-4,4'-piperidine]?
The IUPAC name of 1'-(2-phenylethyl)spiro[2,3-dihydro-1H-naphthalene-4,4'-piperidine] (CID 15163144) is 1'-(2-phenylethyl)spiro[2,3-dihydro-1H-naphthalene-4,4'-piperidine].
What is the SMILES notation for 1'-(2-phenylethyl)spiro[2,3-dihydro-1H-naphthalene-4,4'-piperidine]?
The canonical SMILES for 1'-(2-phenylethyl)spiro[2,3-dihydro-1H-naphthalene-4,4'-piperidine] is c1ccc(CCN2CCC3(CCCc4ccccc43)CC2)cc1.
What is the InChIKey of 1'-(2-phenylethyl)spiro[2,3-dihydro-1H-naphthalene-4,4'-piperidine]?
The InChIKey is WJAIIPYAGQTWCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H27N/c1-2-7-19(8-3-1)12-16-23-17-14-22(15-18-23)13-6-10-20-9-4-5-11-21(20)22/h1-5,7-9,11H,6,10,12-18H2.
What are the key properties of 1'-(2-phenylethyl)spiro[2,3-dihydro-1H-naphthalene-4,4'-piperidine]?
1'-(2-phenylethyl)spiro[2,3-dihydro-1H-naphthalene-4,4'-piperidine] has a molecular weight of 305.46 g/mol, XLogP of 4.60, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1'-(2-phenylethyl)spiro[2,3-dihydro-1H-naphthalene-4,4'-piperidine] is sourced from PubChem (CID 15163144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).