2-[(3-pyridin-2-ylphenyl)methyl]-2,8-diazaspiro[4.5]decane;hydrochloride

C20H26ClN3 — CID 120907330

IUPAC2-[(3-pyridin-2-ylphenyl)methyl]-2,8-diazaspiro[4.5]decane;hydrochloride
SMILESCl.c1ccc(-c2cccc(CN3CCC4(CCNCC4)C3)c2)nc1
InChIInChI=1S/C20H25N3.ClH/c1-2-10-22-19(6-1)18-5-3-4-17(14-18)15-23-13-9-20(16-23)7-11-21-12-8-20;/h1-6,10,14,21H,7-9,11-13,15-16H2;1H
InChIKeyZCSDHDXGYAQIGX-UHFFFAOYSA-N
MW343.90 g/mol
LogP3.75
Rot. Bonds3

About 2-[(3-pyridin-2-ylphenyl)methyl]-2,8-diazaspiro[4.5]decane;hydrochloride

2-[(3-pyridin-2-ylphenyl)methyl]-2,8-diazaspiro[4.5]decane;hydrochloride (PubChem CID 120907330) has the molecular formula C20H26ClN3 and a molecular weight of 343.90 g/mol. Its IUPAC name is 2-[(3-pyridin-2-ylphenyl)methyl]-2,8-diazaspiro[4.5]decane;hydrochloride.

Molecular Properties

Compound Name2-[(3-pyridin-2-ylphenyl)methyl]-2,8-diazaspiro[4.5]decane;hydrochloride
PubChem CID120907330
Molecular FormulaC20H26ClN3
Molecular Weight343.90 g/mol
Exact Mass343.18
IUPAC Name2-[(3-pyridin-2-ylphenyl)methyl]-2,8-diazaspiro[4.5]decane;hydrochloride
SMILESCl.c1ccc(-c2cccc(CN3CCC4(CCNCC4)C3)c2)nc1
InChIInChI=1S/C20H25N3.ClH/c1-2-10-22-19(6-1)18-5-3-4-17(14-18)15-23-13-9-20(16-23)7-11-21-12-8-20;/h1-6,10,14,21H,7-9,11-13,15-16H2;1H
InChIKeyZCSDHDXGYAQIGX-UHFFFAOYSA-N
XLogP3.75
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.90
LogP ≤ 53.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[(3-pyridin-2-ylphenyl)methyl]-2,8-diazaspiro[4.5]decane;hydrochloride 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

2-[(3-pyridin-2-ylphenyl)methyl]-2,7-diazaspiro[4.4]nonane;hydrochloride
CID 120908518
2-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]-2,8-diazaspiro[4.5]decane
CID 120906669
2-[(3,4,5-trifluorophenyl)methyl]-2,8-diazaspiro[4.5]decane;hydrochloride
CID 120906720
2-[(3-propoxyphenyl)methyl]-2,8-diazaspiro[4.5]decane
CID 120906573
2-[(3,4,5-trifluorophenyl)methyl]-2,8-diazaspiro[4.5]decane
CID 120906721
2-[(3,4-dibromophenyl)methyl]-2,8-diazaspiro[4.5]decane;hydrochloride
CID 120906816
2-[(3,5-dimethoxy-4-phenylmethoxyphenyl)methyl]-2,8-diazaspiro[4.5]decane;hydrochloride
CID 120906722
2-(quinolin-8-ylmethyl)-2,8-diazaspiro[4.5]decane
CID 120907566
(5R)-2-benzyl-2,7-diazaspiro[4.4]nonane
CID 34178522
2-[(3-fluorophenyl)methyl]-2,7-diazaspiro[4.4]nonane
CID 82038611
8-benzyl-3,8-diazaspiro[5.6]dodecane
CID 82665591
2-[(6-fluoroquinolin-8-yl)methyl]-2,8-diazaspiro[4.5]decane;hydrochloride
CID 120907414

Frequently Asked Questions

What is the IUPAC name of 2-[(3-pyridin-2-ylphenyl)methyl]-2,8-diazaspiro[4.5]decane;hydrochloride?
The IUPAC name of 2-[(3-pyridin-2-ylphenyl)methyl]-2,8-diazaspiro[4.5]decane;hydrochloride (CID 120907330) is 2-[(3-pyridin-2-ylphenyl)methyl]-2,8-diazaspiro[4.5]decane;hydrochloride.
What is the SMILES notation for 2-[(3-pyridin-2-ylphenyl)methyl]-2,8-diazaspiro[4.5]decane;hydrochloride?
The canonical SMILES for 2-[(3-pyridin-2-ylphenyl)methyl]-2,8-diazaspiro[4.5]decane;hydrochloride is Cl.c1ccc(-c2cccc(CN3CCC4(CCNCC4)C3)c2)nc1.
What is the InChIKey of 2-[(3-pyridin-2-ylphenyl)methyl]-2,8-diazaspiro[4.5]decane;hydrochloride?
The InChIKey is ZCSDHDXGYAQIGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3.ClH/c1-2-10-22-19(6-1)18-5-3-4-17(14-18)15-23-13-9-20(16-23)7-11-21-12-8-20;/h1-6,10,14,21H,7-9,11-13,15-16H2;1H.
What are the key properties of 2-[(3-pyridin-2-ylphenyl)methyl]-2,8-diazaspiro[4.5]decane;hydrochloride?
2-[(3-pyridin-2-ylphenyl)methyl]-2,8-diazaspiro[4.5]decane;hydrochloride has a molecular weight of 343.90 g/mol, XLogP of 3.75, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-pyridin-2-ylphenyl)methyl]-2,8-diazaspiro[4.5]decane;hydrochloride is sourced from PubChem (CID 120907330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).