[2-(aminomethyl)-6-methylmorpholin-4-yl]-(4-methoxyphenyl)methanone

C14H20N2O3 — CID 102938451

IUPAC[2-(aminomethyl)-6-methylmorpholin-4-yl]-(4-methoxyphenyl)methanone
SMILESCOc1ccc(C(=O)N2CC(C)OC(CN)C2)cc1
InChIInChI=1S/C14H20N2O3/c1-10-8-16(9-13(7-15)19-10)14(17)11-3-5-12(18-2)6-4-11/h3-6,10,13H,7-9,15H2,1-2H3
InChIKeyIRGYNSMMLVBJJN-UHFFFAOYSA-N
MW264.32 g/mol
LogP0.88
Rot. Bonds3

About [2-(aminomethyl)-6-methylmorpholin-4-yl]-(4-methoxyphenyl)methanone

[2-(aminomethyl)-6-methylmorpholin-4-yl]-(4-methoxyphenyl)methanone (PubChem CID 102938451) has the molecular formula C14H20N2O3 and a molecular weight of 264.32 g/mol. Its IUPAC name is [2-(aminomethyl)-6-methylmorpholin-4-yl]-(4-methoxyphenyl)methanone.

Molecular Properties

Compound Name[2-(aminomethyl)-6-methylmorpholin-4-yl]-(4-methoxyphenyl)methanone
PubChem CID102938451
Molecular FormulaC14H20N2O3
Molecular Weight264.32 g/mol
Exact Mass264.15
IUPAC Name[2-(aminomethyl)-6-methylmorpholin-4-yl]-(4-methoxyphenyl)methanone
SMILESCOc1ccc(C(=O)N2CC(C)OC(CN)C2)cc1
InChIInChI=1S/C14H20N2O3/c1-10-8-16(9-13(7-15)19-10)14(17)11-3-5-12(18-2)6-4-11/h3-6,10,13H,7-9,15H2,1-2H3
InChIKeyIRGYNSMMLVBJJN-UHFFFAOYSA-N
XLogP0.88
TPSA64.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.32
LogP ≤ 50.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[2-(aminomethyl)-6-methylmorpholin-4-yl]-(3,4-dimethoxyphenyl)methanone
CID 102938320
[2-(aminomethyl)-6-methylmorpholin-4-yl]-(3,4-dihydroxyphenyl)methanone
CID 107727574
[(2S)-2-(aminomethyl)morpholin-4-yl]-(4-methoxyphenyl)methanone
CID 42252495
[2-(aminomethyl)-6-methylmorpholin-4-yl]-[3-(difluoromethoxy)phenyl]methanone
CID 102938275
[4-(aminomethyl)phenyl]-(2-ethyl-6-methylmorpholin-4-yl)methanone;hydrochloride
CID 119304821
[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]-(2,6-dimethylmorpholin-4-yl)methanone
CID 618918
[2-(aminomethyl)-6-methylmorpholin-4-yl]-(2-fluoro-6-methoxyphenyl)methanone
CID 102938283
[2-(aminomethyl)-6-methylmorpholin-4-yl]-(2-hydroxy-3-methoxyphenyl)methanone
CID 102938247
[2-(aminomethyl)-6-methylmorpholin-4-yl]-(3-propoxyphenyl)methanone
CID 102938425
[2-(aminomethyl)-6-methylmorpholin-4-yl]-(1-methylpyrazol-4-yl)methanone
CID 102938421
[2-(aminomethyl)-6-methylmorpholin-4-yl]-(2-methoxy-3-pyridinyl)methanone
CID 102938279
[2-(bromomethyl)-6-methylmorpholin-4-yl]-(3-methoxyphenyl)methanone
CID 102937854

Frequently Asked Questions

What is the IUPAC name of [2-(aminomethyl)-6-methylmorpholin-4-yl]-(4-methoxyphenyl)methanone?
The IUPAC name of [2-(aminomethyl)-6-methylmorpholin-4-yl]-(4-methoxyphenyl)methanone (CID 102938451) is [2-(aminomethyl)-6-methylmorpholin-4-yl]-(4-methoxyphenyl)methanone.
What is the SMILES notation for [2-(aminomethyl)-6-methylmorpholin-4-yl]-(4-methoxyphenyl)methanone?
The canonical SMILES for [2-(aminomethyl)-6-methylmorpholin-4-yl]-(4-methoxyphenyl)methanone is COc1ccc(C(=O)N2CC(C)OC(CN)C2)cc1.
What is the InChIKey of [2-(aminomethyl)-6-methylmorpholin-4-yl]-(4-methoxyphenyl)methanone?
The InChIKey is IRGYNSMMLVBJJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3/c1-10-8-16(9-13(7-15)19-10)14(17)11-3-5-12(18-2)6-4-11/h3-6,10,13H,7-9,15H2,1-2H3.
What are the key properties of [2-(aminomethyl)-6-methylmorpholin-4-yl]-(4-methoxyphenyl)methanone?
[2-(aminomethyl)-6-methylmorpholin-4-yl]-(4-methoxyphenyl)methanone has a molecular weight of 264.32 g/mol, XLogP of 0.88, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(aminomethyl)-6-methylmorpholin-4-yl]-(4-methoxyphenyl)methanone is sourced from PubChem (CID 102938451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).