[2-(2,6-dimethylmorpholin-4-yl)-3,4-dihydro-1H-naphthalen-2-yl]methanamine

C17H26N2O — CID 60796224

IUPAC[2-(2,6-dimethylmorpholin-4-yl)-3,4-dihydro-1H-naphthalen-2-yl]methanamine
SMILESCC1CN(C2(CN)CCc3ccccc3C2)CC(C)O1
InChIInChI=1S/C17H26N2O/c1-13-10-19(11-14(2)20-13)17(12-18)8-7-15-5-3-4-6-16(15)9-17/h3-6,13-14H,7-12,18H2,1-2H3
InChIKeyIOOPVAJGWAHOIY-UHFFFAOYSA-N
MW274.41 g/mol
LogP1.98
Rot. Bonds2

About [2-(2,6-dimethylmorpholin-4-yl)-3,4-dihydro-1H-naphthalen-2-yl]methanamine

[2-(2,6-dimethylmorpholin-4-yl)-3,4-dihydro-1H-naphthalen-2-yl]methanamine (PubChem CID 60796224) has the molecular formula C17H26N2O and a molecular weight of 274.41 g/mol. Its IUPAC name is [2-(2,6-dimethylmorpholin-4-yl)-3,4-dihydro-1H-naphthalen-2-yl]methanamine.

Molecular Properties

Compound Name[2-(2,6-dimethylmorpholin-4-yl)-3,4-dihydro-1H-naphthalen-2-yl]methanamine
PubChem CID60796224
Molecular FormulaC17H26N2O
Molecular Weight274.41 g/mol
Exact Mass274.20
IUPAC Name[2-(2,6-dimethylmorpholin-4-yl)-3,4-dihydro-1H-naphthalen-2-yl]methanamine
SMILESCC1CN(C2(CN)CCc3ccccc3C2)CC(C)O1
InChIInChI=1S/C17H26N2O/c1-13-10-19(11-14(2)20-13)17(12-18)8-7-15-5-3-4-6-16(15)9-17/h3-6,13-14H,7-12,18H2,1-2H3
InChIKeyIOOPVAJGWAHOIY-UHFFFAOYSA-N
XLogP1.98
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 ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [2-(2,6-dimethylmorpholin-4-yl)-3,4-dihydro-1H-naphthalen-2-yl]methanamine?
The IUPAC name of [2-(2,6-dimethylmorpholin-4-yl)-3,4-dihydro-1H-naphthalen-2-yl]methanamine (CID 60796224) is [2-(2,6-dimethylmorpholin-4-yl)-3,4-dihydro-1H-naphthalen-2-yl]methanamine.
What is the SMILES notation for [2-(2,6-dimethylmorpholin-4-yl)-3,4-dihydro-1H-naphthalen-2-yl]methanamine?
The canonical SMILES for [2-(2,6-dimethylmorpholin-4-yl)-3,4-dihydro-1H-naphthalen-2-yl]methanamine is CC1CN(C2(CN)CCc3ccccc3C2)CC(C)O1.
What is the InChIKey of [2-(2,6-dimethylmorpholin-4-yl)-3,4-dihydro-1H-naphthalen-2-yl]methanamine?
The InChIKey is IOOPVAJGWAHOIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O/c1-13-10-19(11-14(2)20-13)17(12-18)8-7-15-5-3-4-6-16(15)9-17/h3-6,13-14H,7-12,18H2,1-2H3.
What are the key properties of [2-(2,6-dimethylmorpholin-4-yl)-3,4-dihydro-1H-naphthalen-2-yl]methanamine?
[2-(2,6-dimethylmorpholin-4-yl)-3,4-dihydro-1H-naphthalen-2-yl]methanamine has a molecular weight of 274.41 g/mol, XLogP of 1.98, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2,6-dimethylmorpholin-4-yl)-3,4-dihydro-1H-naphthalen-2-yl]methanamine is sourced from PubChem (CID 60796224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).