2-(3-methoxypiperidin-1-yl)-4-methyl-1,2,3,4-tetrahydronaphthalen-1-amine

C17H26N2O — CID 102965641

IUPAC2-(3-methoxypiperidin-1-yl)-4-methyl-1,2,3,4-tetrahydronaphthalen-1-amine
SMILESCOC1CCCN(C2CC(C)c3ccccc3C2N)C1
InChIInChI=1S/C17H26N2O/c1-12-10-16(19-9-5-6-13(11-19)20-2)17(18)15-8-4-3-7-14(12)15/h3-4,7-8,12-13,16-17H,5-6,9-11,18H2,1-2H3
InChIKeyKMTAWTGFQUHJLM-UHFFFAOYSA-N
MW274.41 g/mol
LogP2.67
Rot. Bonds2

About 2-(3-methoxypiperidin-1-yl)-4-methyl-1,2,3,4-tetrahydronaphthalen-1-amine

2-(3-methoxypiperidin-1-yl)-4-methyl-1,2,3,4-tetrahydronaphthalen-1-amine (PubChem CID 102965641) has the molecular formula C17H26N2O and a molecular weight of 274.41 g/mol. Its IUPAC name is 2-(3-methoxypiperidin-1-yl)-4-methyl-1,2,3,4-tetrahydronaphthalen-1-amine.

Molecular Properties

Compound Name2-(3-methoxypiperidin-1-yl)-4-methyl-1,2,3,4-tetrahydronaphthalen-1-amine
PubChem CID102965641
Molecular FormulaC17H26N2O
Molecular Weight274.41 g/mol
Exact Mass274.20
IUPAC Name2-(3-methoxypiperidin-1-yl)-4-methyl-1,2,3,4-tetrahydronaphthalen-1-amine
SMILESCOC1CCCN(C2CC(C)c3ccccc3C2N)C1
InChIInChI=1S/C17H26N2O/c1-12-10-16(19-9-5-6-13(11-19)20-2)17(18)15-8-4-3-7-14(12)15/h3-4,7-8,12-13,16-17H,5-6,9-11,18H2,1-2H3
InChIKeyKMTAWTGFQUHJLM-UHFFFAOYSA-N
XLogP2.67
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-methoxypiperidin-1-yl)-4-methyl-1,2,3,4-tetrahydronaphthalen-1-ol
CID 102966127
2-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-4-methyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 115419091
2-(3-methoxypiperidin-1-yl)-2,3-dihydro-1H-inden-1-amine
CID 102965518
2-(3,4-dimethoxypyrrolidin-1-yl)-4-methyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 103532529
2-(3,4-dimethylpyrrolidin-1-yl)-4-methyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 115419084
4-methyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-1,2,3,4-tetrahydronaphthalen-1-amine
CID 115419081
3-(3-methoxypyrrolidin-1-yl)-3,4-dihydro-2H-chromen-4-amine
CID 103532291
2-(4-methoxypiperidin-1-yl)-4-methyl-1,2,3,4-tetrahydronaphthalen-1-ol
CID 115420002
2-(3-methoxypiperidin-1-yl)-4-methylcyclohexan-1-ol
CID 102966101
4-methyl-2-(3-methylpiperidin-1-yl)-1,2,3,4-tetrahydronaphthalen-1-ol
CID 115419975
2-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-4-methyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 115419012
4-methyl-2-(2,2,6-trimethylmorpholin-4-yl)-1,2,3,4-tetrahydronaphthalen-1-amine
CID 115419000

Frequently Asked Questions

What is the IUPAC name of 2-(3-methoxypiperidin-1-yl)-4-methyl-1,2,3,4-tetrahydronaphthalen-1-amine?
The IUPAC name of 2-(3-methoxypiperidin-1-yl)-4-methyl-1,2,3,4-tetrahydronaphthalen-1-amine (CID 102965641) is 2-(3-methoxypiperidin-1-yl)-4-methyl-1,2,3,4-tetrahydronaphthalen-1-amine.
What is the SMILES notation for 2-(3-methoxypiperidin-1-yl)-4-methyl-1,2,3,4-tetrahydronaphthalen-1-amine?
The canonical SMILES for 2-(3-methoxypiperidin-1-yl)-4-methyl-1,2,3,4-tetrahydronaphthalen-1-amine is COC1CCCN(C2CC(C)c3ccccc3C2N)C1.
What is the InChIKey of 2-(3-methoxypiperidin-1-yl)-4-methyl-1,2,3,4-tetrahydronaphthalen-1-amine?
The InChIKey is KMTAWTGFQUHJLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O/c1-12-10-16(19-9-5-6-13(11-19)20-2)17(18)15-8-4-3-7-14(12)15/h3-4,7-8,12-13,16-17H,5-6,9-11,18H2,1-2H3.
What are the key properties of 2-(3-methoxypiperidin-1-yl)-4-methyl-1,2,3,4-tetrahydronaphthalen-1-amine?
2-(3-methoxypiperidin-1-yl)-4-methyl-1,2,3,4-tetrahydronaphthalen-1-amine has a molecular weight of 274.41 g/mol, XLogP of 2.67, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methoxypiperidin-1-yl)-4-methyl-1,2,3,4-tetrahydronaphthalen-1-amine is sourced from PubChem (CID 102965641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).