[4-[(3-methoxyphenyl)methyl]-6,6-dimethylmorpholin-2-yl]methanamine

C15H24N2O2 — CID 114782598

IUPAC[4-[(3-methoxyphenyl)methyl]-6,6-dimethylmorpholin-2-yl]methanamine
SMILESCOc1cccc(CN2CC(CN)OC(C)(C)C2)c1
InChIInChI=1S/C15H24N2O2/c1-15(2)11-17(10-14(8-16)19-15)9-12-5-4-6-13(7-12)18-3/h4-7,14H,8-11,16H2,1-3H3
InChIKeyJNILEVNVQGKKRB-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.63
Rot. Bonds4

About [4-[(3-methoxyphenyl)methyl]-6,6-dimethylmorpholin-2-yl]methanamine

[4-[(3-methoxyphenyl)methyl]-6,6-dimethylmorpholin-2-yl]methanamine (PubChem CID 114782598) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is [4-[(3-methoxyphenyl)methyl]-6,6-dimethylmorpholin-2-yl]methanamine.

Molecular Properties

Compound Name[4-[(3-methoxyphenyl)methyl]-6,6-dimethylmorpholin-2-yl]methanamine
PubChem CID114782598
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name[4-[(3-methoxyphenyl)methyl]-6,6-dimethylmorpholin-2-yl]methanamine
SMILESCOc1cccc(CN2CC(CN)OC(C)(C)C2)c1
InChIInChI=1S/C15H24N2O2/c1-15(2)11-17(10-14(8-16)19-15)9-12-5-4-6-13(7-12)18-3/h4-7,14H,8-11,16H2,1-3H3
InChIKeyJNILEVNVQGKKRB-UHFFFAOYSA-N
XLogP1.63
TPSA47.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze [4-[(3-methoxyphenyl)methyl]-6,6-dimethylmorpholin-2-yl]methanamine with MolForge

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Related Compounds

[4-[(3-methoxyphenyl)methyl]-6-methylmorpholin-2-yl]methanamine
CID 102938955
1-[(3-methoxyphenyl)methyl]-3,5-dimethylpiperazine
CID 63863142
[6,6-dimethyl-4-[(3-nitrophenyl)methyl]morpholin-2-yl]methanol
CID 114779835
3-[[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]methyl]benzoic acid
CID 114777343
3-[(3-methoxyphenyl)methyl]-9-oxa-3,7-diazabicyclo[3.3.1]nonane
CID 67380464
2-(chloromethyl)-4-[(3-methoxyphenyl)methyl]morpholine
CID 81213549
2-benzyl-5-[(3-methoxyphenyl)methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole
CID 155875929
[4-[(2,5-dimethoxyphenyl)methyl]-6,6-dimethylmorpholin-2-yl]methanol
CID 114779927
[1-[(3-methoxyphenyl)methyl]-4-(trifluoromethyl)piperidin-3-yl]methanamine
CID 166244914
(3R)-1-[(3-methoxyphenyl)methyl]pyrrolidin-3-amine
CID 24904638
1-[6-(bromomethyl)-2,2-dimethylmorpholin-4-yl]-2-(3-methoxyphenyl)ethanone
CID 114781425
4-[[6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]methyl]pyridin-2-amine
CID 128975935

Frequently Asked Questions

What is the IUPAC name of [4-[(3-methoxyphenyl)methyl]-6,6-dimethylmorpholin-2-yl]methanamine?
The IUPAC name of [4-[(3-methoxyphenyl)methyl]-6,6-dimethylmorpholin-2-yl]methanamine (CID 114782598) is [4-[(3-methoxyphenyl)methyl]-6,6-dimethylmorpholin-2-yl]methanamine.
What is the SMILES notation for [4-[(3-methoxyphenyl)methyl]-6,6-dimethylmorpholin-2-yl]methanamine?
The canonical SMILES for [4-[(3-methoxyphenyl)methyl]-6,6-dimethylmorpholin-2-yl]methanamine is COc1cccc(CN2CC(CN)OC(C)(C)C2)c1.
What is the InChIKey of [4-[(3-methoxyphenyl)methyl]-6,6-dimethylmorpholin-2-yl]methanamine?
The InChIKey is JNILEVNVQGKKRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-15(2)11-17(10-14(8-16)19-15)9-12-5-4-6-13(7-12)18-3/h4-7,14H,8-11,16H2,1-3H3.
What are the key properties of [4-[(3-methoxyphenyl)methyl]-6,6-dimethylmorpholin-2-yl]methanamine?
[4-[(3-methoxyphenyl)methyl]-6,6-dimethylmorpholin-2-yl]methanamine has a molecular weight of 264.37 g/mol, XLogP of 1.63, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[(3-methoxyphenyl)methyl]-6,6-dimethylmorpholin-2-yl]methanamine is sourced from PubChem (CID 114782598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).