1-(6-amino-1,2,3,4-tetrahydronaphthalen-1-yl)-4-methylpiperidine-2,6-dione

C16H20N2O2 — CID 116650629

IUPAC1-(6-amino-1,2,3,4-tetrahydronaphthalen-1-yl)-4-methylpiperidine-2,6-dione
SMILESCC1CC(=O)N(C2CCCc3cc(N)ccc32)C(=O)C1
InChIInChI=1S/C16H20N2O2/c1-10-7-15(19)18(16(20)8-10)14-4-2-3-11-9-12(17)5-6-13(11)14/h5-6,9-10,14H,2-4,7-8,17H2,1H3
InChIKeyUOPJGEALOATRJC-UHFFFAOYSA-N
MW272.35 g/mol
LogP2.43
Rot. Bonds1

About 1-(6-amino-1,2,3,4-tetrahydronaphthalen-1-yl)-4-methylpiperidine-2,6-dione

1-(6-amino-1,2,3,4-tetrahydronaphthalen-1-yl)-4-methylpiperidine-2,6-dione (PubChem CID 116650629) has the molecular formula C16H20N2O2 and a molecular weight of 272.35 g/mol. Its IUPAC name is 1-(6-amino-1,2,3,4-tetrahydronaphthalen-1-yl)-4-methylpiperidine-2,6-dione.

Molecular Properties

Compound Name1-(6-amino-1,2,3,4-tetrahydronaphthalen-1-yl)-4-methylpiperidine-2,6-dione
PubChem CID116650629
Molecular FormulaC16H20N2O2
Molecular Weight272.35 g/mol
Exact Mass272.15
IUPAC Name1-(6-amino-1,2,3,4-tetrahydronaphthalen-1-yl)-4-methylpiperidine-2,6-dione
SMILESCC1CC(=O)N(C2CCCc3cc(N)ccc32)C(=O)C1
InChIInChI=1S/C16H20N2O2/c1-10-7-15(19)18(16(20)8-10)14-4-2-3-11-9-12(17)5-6-13(11)14/h5-6,9-10,14H,2-4,7-8,17H2,1H3
InChIKeyUOPJGEALOATRJC-UHFFFAOYSA-N
XLogP2.43
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

5-pyrrol-1-yl-5,6,7,8-tetrahydronaphthalen-2-amine
CID 116650626
5-piperidin-1-yl-5,6,7,8-tetrahydronaphthalen-2-amine
CID 116650618
5-(5-methylimidazol-1-yl)-5,6,7,8-tetrahydronaphthalen-2-amine
CID 116650674
1-(2,5-dimethylpiperidin-1-yl)-2,3-dihydro-1H-inden-5-amine
CID 79741366
4-(5-amino-2,3-dihydro-1H-inden-1-yl)-1-methyl-1,4-diazepan-2-one
CID 102887555
4-(5-amino-2,3-dihydro-1H-inden-1-yl)-3-methylpiperazin-2-one
CID 79741089
1-(2,3,3a,4,5,6,7,7a-octahydroindol-1-yl)-2,3-dihydro-1H-inden-5-amine
CID 82751547
1-N-(2,6-dimethylpiperidin-1-yl)-2,3-dihydro-1H-indene-1,5-diamine
CID 83009052
1-(2-azaspiro[3.5]nonan-2-yl)-2,3-dihydro-1H-inden-5-amine
CID 79746635
1-(2-azaspiro[3.6]decan-2-yl)-2,3-dihydro-1H-inden-5-amine
CID 79721711
1-(3-methyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-2,3-dihydro-1H-inden-5-amine
CID 79936509
6-(5-amino-2,3-dihydro-1H-inden-1-yl)pyrrolo[3,4-b]pyridine-5,7-dione
CID 79721891

Frequently Asked Questions

What is the IUPAC name of 1-(6-amino-1,2,3,4-tetrahydronaphthalen-1-yl)-4-methylpiperidine-2,6-dione?
The IUPAC name of 1-(6-amino-1,2,3,4-tetrahydronaphthalen-1-yl)-4-methylpiperidine-2,6-dione (CID 116650629) is 1-(6-amino-1,2,3,4-tetrahydronaphthalen-1-yl)-4-methylpiperidine-2,6-dione.
What is the SMILES notation for 1-(6-amino-1,2,3,4-tetrahydronaphthalen-1-yl)-4-methylpiperidine-2,6-dione?
The canonical SMILES for 1-(6-amino-1,2,3,4-tetrahydronaphthalen-1-yl)-4-methylpiperidine-2,6-dione is CC1CC(=O)N(C2CCCc3cc(N)ccc32)C(=O)C1.
What is the InChIKey of 1-(6-amino-1,2,3,4-tetrahydronaphthalen-1-yl)-4-methylpiperidine-2,6-dione?
The InChIKey is UOPJGEALOATRJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O2/c1-10-7-15(19)18(16(20)8-10)14-4-2-3-11-9-12(17)5-6-13(11)14/h5-6,9-10,14H,2-4,7-8,17H2,1H3.
What are the key properties of 1-(6-amino-1,2,3,4-tetrahydronaphthalen-1-yl)-4-methylpiperidine-2,6-dione?
1-(6-amino-1,2,3,4-tetrahydronaphthalen-1-yl)-4-methylpiperidine-2,6-dione has a molecular weight of 272.35 g/mol, XLogP of 2.43, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-amino-1,2,3,4-tetrahydronaphthalen-1-yl)-4-methylpiperidine-2,6-dione is sourced from PubChem (CID 116650629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).