3'-(2-chlorophenyl)spiro[1-azabicyclo[3.2.1]octane-4,4'-piperidine]

C17H23ClN2 — CID 105366329

IUPAC3'-(2-chlorophenyl)spiro[1-azabicyclo[3.2.1]octane-4,4'-piperidine]
SMILESClc1ccccc1C1CNCCC12CCN1CCC2C1
InChIInChI=1S/C17H23ClN2/c18-16-4-2-1-3-14(16)15-11-19-8-6-17(15)7-10-20-9-5-13(17)12-20/h1-4,13,15,19H,5-12H2
InChIKeyFCXJRDSNGWBTMA-UHFFFAOYSA-N
MW290.84 g/mol
LogP3.13
Rot. Bonds1

About 3'-(2-chlorophenyl)spiro[1-azabicyclo[3.2.1]octane-4,4'-piperidine]

3'-(2-chlorophenyl)spiro[1-azabicyclo[3.2.1]octane-4,4'-piperidine] (PubChem CID 105366329) has the molecular formula C17H23ClN2 and a molecular weight of 290.84 g/mol. Its IUPAC name is 3'-(2-chlorophenyl)spiro[1-azabicyclo[3.2.1]octane-4,4'-piperidine].

Molecular Properties

Compound Name3'-(2-chlorophenyl)spiro[1-azabicyclo[3.2.1]octane-4,4'-piperidine]
PubChem CID105366329
Molecular FormulaC17H23ClN2
Molecular Weight290.84 g/mol
Exact Mass290.15
IUPAC Name3'-(2-chlorophenyl)spiro[1-azabicyclo[3.2.1]octane-4,4'-piperidine]
SMILESClc1ccccc1C1CNCCC12CCN1CCC2C1
InChIInChI=1S/C17H23ClN2/c18-16-4-2-1-3-14(16)15-11-19-8-6-17(15)7-10-20-9-5-13(17)12-20/h1-4,13,15,19H,5-12H2
InChIKeyFCXJRDSNGWBTMA-UHFFFAOYSA-N
XLogP3.13
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.84
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3'-(2-chlorophenyl)spiro[1-azabicyclo[3.2.1]octane-4,4'-piperidine] with MolForge

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Related Compounds

3'-(2-chlorophenyl)spiro[1,2,3,5,6,8-hexahydropyrrolizine-7,4'-piperidine]
CID 82856484
3'-benzylspiro[1-azabicyclo[3.2.1]octane-4,4'-piperidine]
CID 105366313
5-(2-chlorophenyl)-11-methyl-3-azaspiro[5.5]undecane
CID 79454434
5-(2-chlorophenyl)-3-azaspiro[5.5]undecane
CID 79454124
3'-(2-fluorophenyl)spiro[1,2,3,5,6,8-hexahydropyrrolizine-7,4'-piperidine]
CID 82855956
(4R)-2-tert-butyl-4-(2-chlorophenyl)-2,8-diazaspiro[4.5]decan-1-one
CID 99946061
3-(2-chlorophenyl)-4-(3,5-dichlorophenyl)piperidine
CID 79439665
4-[(3-chloro-2-fluorophenyl)methyl]-1-azabicyclo[3.2.1]octan-4-ol
CID 102857072
2-[2-(2-chlorophenyl)piperazin-1-yl]sulfonyl-2-azabicyclo[2.2.1]heptane
CID 120765027
[2-(2-chlorophenyl)piperazin-1-yl]-cyclopentylmethanone
CID 120739912
3'-(4-chlorophenyl)spiro[1,2,3,5,6,8-hexahydropyrrolizine-7,4'-piperidine]
CID 82855837
(2R)-2-(2-chlorophenyl)-1-phenyl-1,4-diazepane
CID 124565905

Frequently Asked Questions

What is the IUPAC name of 3'-(2-chlorophenyl)spiro[1-azabicyclo[3.2.1]octane-4,4'-piperidine]?
The IUPAC name of 3'-(2-chlorophenyl)spiro[1-azabicyclo[3.2.1]octane-4,4'-piperidine] (CID 105366329) is 3'-(2-chlorophenyl)spiro[1-azabicyclo[3.2.1]octane-4,4'-piperidine].
What is the SMILES notation for 3'-(2-chlorophenyl)spiro[1-azabicyclo[3.2.1]octane-4,4'-piperidine]?
The canonical SMILES for 3'-(2-chlorophenyl)spiro[1-azabicyclo[3.2.1]octane-4,4'-piperidine] is Clc1ccccc1C1CNCCC12CCN1CCC2C1.
What is the InChIKey of 3'-(2-chlorophenyl)spiro[1-azabicyclo[3.2.1]octane-4,4'-piperidine]?
The InChIKey is FCXJRDSNGWBTMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23ClN2/c18-16-4-2-1-3-14(16)15-11-19-8-6-17(15)7-10-20-9-5-13(17)12-20/h1-4,13,15,19H,5-12H2.
What are the key properties of 3'-(2-chlorophenyl)spiro[1-azabicyclo[3.2.1]octane-4,4'-piperidine]?
3'-(2-chlorophenyl)spiro[1-azabicyclo[3.2.1]octane-4,4'-piperidine] has a molecular weight of 290.84 g/mol, XLogP of 3.13, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3'-(2-chlorophenyl)spiro[1-azabicyclo[3.2.1]octane-4,4'-piperidine] is sourced from PubChem (CID 105366329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).