N-methyl-1-(3-methylphenyl)-2-(2,2,6,6-tetramethylmorpholin-4-yl)ethanamine

C18H30N2O — CID 102743532

IUPACN-methyl-1-(3-methylphenyl)-2-(2,2,6,6-tetramethylmorpholin-4-yl)ethanamine
SMILESCNC(CN1CC(C)(C)OC(C)(C)C1)c1cccc(C)c1
InChIInChI=1S/C18H30N2O/c1-14-8-7-9-15(10-14)16(19-6)11-20-12-17(2,3)21-18(4,5)13-20/h7-10,16,19H,11-13H2,1-6H3
InChIKeyYJMNEFILBHMPIN-UHFFFAOYSA-N
MW290.45 g/mol
LogP3.14
Rot. Bonds4

About N-methyl-1-(3-methylphenyl)-2-(2,2,6,6-tetramethylmorpholin-4-yl)ethanamine

N-methyl-1-(3-methylphenyl)-2-(2,2,6,6-tetramethylmorpholin-4-yl)ethanamine (PubChem CID 102743532) has the molecular formula C18H30N2O and a molecular weight of 290.45 g/mol. Its IUPAC name is N-methyl-1-(3-methylphenyl)-2-(2,2,6,6-tetramethylmorpholin-4-yl)ethanamine.

Molecular Properties

Compound NameN-methyl-1-(3-methylphenyl)-2-(2,2,6,6-tetramethylmorpholin-4-yl)ethanamine
PubChem CID102743532
Molecular FormulaC18H30N2O
Molecular Weight290.45 g/mol
Exact Mass290.24
IUPAC NameN-methyl-1-(3-methylphenyl)-2-(2,2,6,6-tetramethylmorpholin-4-yl)ethanamine
SMILESCNC(CN1CC(C)(C)OC(C)(C)C1)c1cccc(C)c1
InChIInChI=1S/C18H30N2O/c1-14-8-7-9-15(10-14)16(19-6)11-20-12-17(2,3)21-18(4,5)13-20/h7-10,16,19H,11-13H2,1-6H3
InChIKeyYJMNEFILBHMPIN-UHFFFAOYSA-N
XLogP3.14
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.45
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-1-(3-methylphenyl)-2-pyrrolidin-1-ylethanamine
CID 20735110
2-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-N-methyl-1-(3-methylphenyl)ethanamine
CID 115559669
tert-butyl-hydroxy-dimethylsilane;(1S)-N-methyl-1-(3-methylphenyl)-2-pyrrolidin-1-ylethanamine;sulfane
CID 161283631
2-(3,4-dimethylpiperazin-1-yl)-N-methyl-1-(3-methylphenyl)ethanamine
CID 55215794
2-(1,3,4,5,7,8,9,9a-octahydropyrrolo[1,2-a][1,4]diazepin-2-yl)-N-methyl-1-(3-methylphenyl)ethanamine
CID 63149736
2-(5-chlorothiophen-2-yl)-N-methyl-1-(3-methylphenyl)ethanamine
CID 55095022
1-[2-(methylamino)-2-(3-methylphenyl)ethyl]-3-propylimidazol-2-one
CID 80581733
4-(methylamino)-4-(3-methylphenyl)butan-2-one
CID 116956083
2-cycloheptyl-N-methyl-1-(3-methylphenyl)ethanamine
CID 115789919
N-methyl-1-(3-methylphenyl)-2-(2-propylpiperidin-1-yl)ethanamine
CID 83052318
N-methyl-1-(3-methylphenyl)decan-1-amine
CID 55186614
N-methyl-1-(3-methylphenyl)-3-phenylpropan-1-amine
CID 60818529

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(3-methylphenyl)-2-(2,2,6,6-tetramethylmorpholin-4-yl)ethanamine?
The IUPAC name of N-methyl-1-(3-methylphenyl)-2-(2,2,6,6-tetramethylmorpholin-4-yl)ethanamine (CID 102743532) is N-methyl-1-(3-methylphenyl)-2-(2,2,6,6-tetramethylmorpholin-4-yl)ethanamine.
What is the SMILES notation for N-methyl-1-(3-methylphenyl)-2-(2,2,6,6-tetramethylmorpholin-4-yl)ethanamine?
The canonical SMILES for N-methyl-1-(3-methylphenyl)-2-(2,2,6,6-tetramethylmorpholin-4-yl)ethanamine is CNC(CN1CC(C)(C)OC(C)(C)C1)c1cccc(C)c1.
What is the InChIKey of N-methyl-1-(3-methylphenyl)-2-(2,2,6,6-tetramethylmorpholin-4-yl)ethanamine?
The InChIKey is YJMNEFILBHMPIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30N2O/c1-14-8-7-9-15(10-14)16(19-6)11-20-12-17(2,3)21-18(4,5)13-20/h7-10,16,19H,11-13H2,1-6H3.
What are the key properties of N-methyl-1-(3-methylphenyl)-2-(2,2,6,6-tetramethylmorpholin-4-yl)ethanamine?
N-methyl-1-(3-methylphenyl)-2-(2,2,6,6-tetramethylmorpholin-4-yl)ethanamine has a molecular weight of 290.45 g/mol, XLogP of 3.14, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(3-methylphenyl)-2-(2,2,6,6-tetramethylmorpholin-4-yl)ethanamine is sourced from PubChem (CID 102743532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).