1'-[2-(dimethylamino)propyl]-6-methylspiro[2,3-dihydro-1H-naphthalene-4,3'-pyrrolidine]-2',5'-dione;hydrochloride

C19H27ClN2O2 — CID 3059300

IUPAC1'-[2-(dimethylamino)propyl]-6-methylspiro[2,3-dihydro-1H-naphthalene-4,3'-pyrrolidine]-2',5'-dione;hydrochloride
SMILESCc1ccc2c(c1)C1(CCC2)CC(=O)N(CC(C)N(C)C)C1=O.Cl
InChIInChI=1S/C19H26N2O2.ClH/c1-13-7-8-15-6-5-9-19(16(15)10-13)11-17(22)21(18(19)23)12-14(2)20(3)4;/h7-8,10,14H,5-6,9,11-12H2,1-4H3;1H
InChIKeyWOKUBHDENAHEEJ-UHFFFAOYSA-N
MW350.89 g/mol
LogP2.70
Rot. Bonds3

About 1'-[2-(dimethylamino)propyl]-6-methylspiro[2,3-dihydro-1H-naphthalene-4,3'-pyrrolidine]-2',5'-dione;hydrochloride

1'-[2-(dimethylamino)propyl]-6-methylspiro[2,3-dihydro-1H-naphthalene-4,3'-pyrrolidine]-2',5'-dione;hydrochloride (PubChem CID 3059300) has the molecular formula C19H27ClN2O2 and a molecular weight of 350.89 g/mol. Its IUPAC name is 1'-[2-(dimethylamino)propyl]-6-methylspiro[2,3-dihydro-1H-naphthalene-4,3'-pyrrolidine]-2',5'-dione;hydrochloride.

Molecular Properties

Compound Name1'-[2-(dimethylamino)propyl]-6-methylspiro[2,3-dihydro-1H-naphthalene-4,3'-pyrrolidine]-2',5'-dione;hydrochloride
PubChem CID3059300
Molecular FormulaC19H27ClN2O2
Molecular Weight350.89 g/mol
Exact Mass350.18
IUPAC Name1'-[2-(dimethylamino)propyl]-6-methylspiro[2,3-dihydro-1H-naphthalene-4,3'-pyrrolidine]-2',5'-dione;hydrochloride
SMILESCc1ccc2c(c1)C1(CCC2)CC(=O)N(CC(C)N(C)C)C1=O.Cl
InChIInChI=1S/C19H26N2O2.ClH/c1-13-7-8-15-6-5-9-19(16(15)10-13)11-17(22)21(18(19)23)12-14(2)20(3)4;/h7-8,10,14H,5-6,9,11-12H2,1-4H3;1H
InChIKeyWOKUBHDENAHEEJ-UHFFFAOYSA-N
XLogP2.70
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.89
LogP ≤ 52.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phthalimide', 'substructure': 'N/A'}

Analyze 1'-[2-(dimethylamino)propyl]-6-methylspiro[2,3-dihydro-1H-naphthalene-4,3'-pyrrolidine]-2',5'-dione;hydrochloride 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-(dimethylamino)propyl]-6-methylspiro[2,3-dihydro-1H-naphthalene-4,3'-pyrrolidine]-2',5'-dione;hydrochloride?
The IUPAC name of 1'-[2-(dimethylamino)propyl]-6-methylspiro[2,3-dihydro-1H-naphthalene-4,3'-pyrrolidine]-2',5'-dione;hydrochloride (CID 3059300) is 1'-[2-(dimethylamino)propyl]-6-methylspiro[2,3-dihydro-1H-naphthalene-4,3'-pyrrolidine]-2',5'-dione;hydrochloride.
What is the SMILES notation for 1'-[2-(dimethylamino)propyl]-6-methylspiro[2,3-dihydro-1H-naphthalene-4,3'-pyrrolidine]-2',5'-dione;hydrochloride?
The canonical SMILES for 1'-[2-(dimethylamino)propyl]-6-methylspiro[2,3-dihydro-1H-naphthalene-4,3'-pyrrolidine]-2',5'-dione;hydrochloride is Cc1ccc2c(c1)C1(CCC2)CC(=O)N(CC(C)N(C)C)C1=O.Cl.
What is the InChIKey of 1'-[2-(dimethylamino)propyl]-6-methylspiro[2,3-dihydro-1H-naphthalene-4,3'-pyrrolidine]-2',5'-dione;hydrochloride?
The InChIKey is WOKUBHDENAHEEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N2O2.ClH/c1-13-7-8-15-6-5-9-19(16(15)10-13)11-17(22)21(18(19)23)12-14(2)20(3)4;/h7-8,10,14H,5-6,9,11-12H2,1-4H3;1H.
What are the key properties of 1'-[2-(dimethylamino)propyl]-6-methylspiro[2,3-dihydro-1H-naphthalene-4,3'-pyrrolidine]-2',5'-dione;hydrochloride?
1'-[2-(dimethylamino)propyl]-6-methylspiro[2,3-dihydro-1H-naphthalene-4,3'-pyrrolidine]-2',5'-dione;hydrochloride has a molecular weight of 350.89 g/mol, XLogP of 2.70, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1'-[2-(dimethylamino)propyl]-6-methylspiro[2,3-dihydro-1H-naphthalene-4,3'-pyrrolidine]-2',5'-dione;hydrochloride is sourced from PubChem (CID 3059300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).