[2-(aminomethyl)-6-methylpiperidin-1-yl]-(1,2,3,4-tetrahydronaphthalen-2-yl)methanone

C18H26N2O — CID 107127252

IUPAC[2-(aminomethyl)-6-methylpiperidin-1-yl]-(1,2,3,4-tetrahydronaphthalen-2-yl)methanone
SMILESCC1CCCC(CN)N1C(=O)C1CCc2ccccc2C1
InChIInChI=1S/C18H26N2O/c1-13-5-4-8-17(12-19)20(13)18(21)16-10-9-14-6-2-3-7-15(14)11-16/h2-3,6-7,13,16-17H,4-5,8-12,19H2,1H3
InChIKeyAWCUQMIPXBRNSY-UHFFFAOYSA-N
MW286.42 g/mol
LogP2.52
Rot. Bonds2

About [2-(aminomethyl)-6-methylpiperidin-1-yl]-(1,2,3,4-tetrahydronaphthalen-2-yl)methanone

[2-(aminomethyl)-6-methylpiperidin-1-yl]-(1,2,3,4-tetrahydronaphthalen-2-yl)methanone (PubChem CID 107127252) has the molecular formula C18H26N2O and a molecular weight of 286.42 g/mol. Its IUPAC name is [2-(aminomethyl)-6-methylpiperidin-1-yl]-(1,2,3,4-tetrahydronaphthalen-2-yl)methanone.

Molecular Properties

Compound Name[2-(aminomethyl)-6-methylpiperidin-1-yl]-(1,2,3,4-tetrahydronaphthalen-2-yl)methanone
PubChem CID107127252
Molecular FormulaC18H26N2O
Molecular Weight286.42 g/mol
Exact Mass286.20
IUPAC Name[2-(aminomethyl)-6-methylpiperidin-1-yl]-(1,2,3,4-tetrahydronaphthalen-2-yl)methanone
SMILESCC1CCCC(CN)N1C(=O)C1CCc2ccccc2C1
InChIInChI=1S/C18H26N2O/c1-13-5-4-8-17(12-19)20(13)18(21)16-10-9-14-6-2-3-7-15(14)11-16/h2-3,6-7,13,16-17H,4-5,8-12,19H2,1H3
InChIKeyAWCUQMIPXBRNSY-UHFFFAOYSA-N
XLogP2.52
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.42
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze [2-(aminomethyl)-6-methylpiperidin-1-yl]-(1,2,3,4-tetrahydronaphthalen-2-yl)methanone 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 [2-(aminomethyl)-6-methylpiperidin-1-yl]-(1,2,3,4-tetrahydronaphthalen-2-yl)methanone?
The IUPAC name of [2-(aminomethyl)-6-methylpiperidin-1-yl]-(1,2,3,4-tetrahydronaphthalen-2-yl)methanone (CID 107127252) is [2-(aminomethyl)-6-methylpiperidin-1-yl]-(1,2,3,4-tetrahydronaphthalen-2-yl)methanone.
What is the SMILES notation for [2-(aminomethyl)-6-methylpiperidin-1-yl]-(1,2,3,4-tetrahydronaphthalen-2-yl)methanone?
The canonical SMILES for [2-(aminomethyl)-6-methylpiperidin-1-yl]-(1,2,3,4-tetrahydronaphthalen-2-yl)methanone is CC1CCCC(CN)N1C(=O)C1CCc2ccccc2C1.
What is the InChIKey of [2-(aminomethyl)-6-methylpiperidin-1-yl]-(1,2,3,4-tetrahydronaphthalen-2-yl)methanone?
The InChIKey is AWCUQMIPXBRNSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O/c1-13-5-4-8-17(12-19)20(13)18(21)16-10-9-14-6-2-3-7-15(14)11-16/h2-3,6-7,13,16-17H,4-5,8-12,19H2,1H3.
What are the key properties of [2-(aminomethyl)-6-methylpiperidin-1-yl]-(1,2,3,4-tetrahydronaphthalen-2-yl)methanone?
[2-(aminomethyl)-6-methylpiperidin-1-yl]-(1,2,3,4-tetrahydronaphthalen-2-yl)methanone has a molecular weight of 286.42 g/mol, XLogP of 2.52, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(aminomethyl)-6-methylpiperidin-1-yl]-(1,2,3,4-tetrahydronaphthalen-2-yl)methanone is sourced from PubChem (CID 107127252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).