4-methyl-2-(2,2,6-trimethylmorpholin-4-yl)-1,2,3,4-tetrahydronaphthalen-1-amine

C18H28N2O — CID 115419000

IUPAC4-methyl-2-(2,2,6-trimethylmorpholin-4-yl)-1,2,3,4-tetrahydronaphthalen-1-amine
SMILESCC1CN(C2CC(C)c3ccccc3C2N)CC(C)(C)O1
InChIInChI=1S/C18H28N2O/c1-12-9-16(17(19)15-8-6-5-7-14(12)15)20-10-13(2)21-18(3,4)11-20/h5-8,12-13,16-17H,9-11,19H2,1-4H3
InChIKeyPDCORVTUBCJMJE-UHFFFAOYSA-N
MW288.43 g/mol
LogP3.06
Rot. Bonds1

About 4-methyl-2-(2,2,6-trimethylmorpholin-4-yl)-1,2,3,4-tetrahydronaphthalen-1-amine

4-methyl-2-(2,2,6-trimethylmorpholin-4-yl)-1,2,3,4-tetrahydronaphthalen-1-amine (PubChem CID 115419000) has the molecular formula C18H28N2O and a molecular weight of 288.43 g/mol. Its IUPAC name is 4-methyl-2-(2,2,6-trimethylmorpholin-4-yl)-1,2,3,4-tetrahydronaphthalen-1-amine.

Molecular Properties

Compound Name4-methyl-2-(2,2,6-trimethylmorpholin-4-yl)-1,2,3,4-tetrahydronaphthalen-1-amine
PubChem CID115419000
Molecular FormulaC18H28N2O
Molecular Weight288.43 g/mol
Exact Mass288.22
IUPAC Name4-methyl-2-(2,2,6-trimethylmorpholin-4-yl)-1,2,3,4-tetrahydronaphthalen-1-amine
SMILESCC1CN(C2CC(C)c3ccccc3C2N)CC(C)(C)O1
InChIInChI=1S/C18H28N2O/c1-12-9-16(17(19)15-8-6-5-7-14(12)15)20-10-13(2)21-18(3,4)11-20/h5-8,12-13,16-17H,9-11,19H2,1-4H3
InChIKeyPDCORVTUBCJMJE-UHFFFAOYSA-N
XLogP3.06
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.43
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-(2,2,6-trimethylmorpholin-4-yl)-1,2,3,4-tetrahydronaphthalen-1-amine?
The IUPAC name of 4-methyl-2-(2,2,6-trimethylmorpholin-4-yl)-1,2,3,4-tetrahydronaphthalen-1-amine (CID 115419000) is 4-methyl-2-(2,2,6-trimethylmorpholin-4-yl)-1,2,3,4-tetrahydronaphthalen-1-amine.
What is the SMILES notation for 4-methyl-2-(2,2,6-trimethylmorpholin-4-yl)-1,2,3,4-tetrahydronaphthalen-1-amine?
The canonical SMILES for 4-methyl-2-(2,2,6-trimethylmorpholin-4-yl)-1,2,3,4-tetrahydronaphthalen-1-amine is CC1CN(C2CC(C)c3ccccc3C2N)CC(C)(C)O1.
What is the InChIKey of 4-methyl-2-(2,2,6-trimethylmorpholin-4-yl)-1,2,3,4-tetrahydronaphthalen-1-amine?
The InChIKey is PDCORVTUBCJMJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2O/c1-12-9-16(17(19)15-8-6-5-7-14(12)15)20-10-13(2)21-18(3,4)11-20/h5-8,12-13,16-17H,9-11,19H2,1-4H3.
What are the key properties of 4-methyl-2-(2,2,6-trimethylmorpholin-4-yl)-1,2,3,4-tetrahydronaphthalen-1-amine?
4-methyl-2-(2,2,6-trimethylmorpholin-4-yl)-1,2,3,4-tetrahydronaphthalen-1-amine has a molecular weight of 288.43 g/mol, XLogP of 3.06, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-(2,2,6-trimethylmorpholin-4-yl)-1,2,3,4-tetrahydronaphthalen-1-amine is sourced from PubChem (CID 115419000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).