[4-methoxy-3-[(4-methylmorpholin-2-yl)methoxy]phenyl]methanamine

C14H22N2O3 — CID 79166947

IUPAC[4-methoxy-3-[(4-methylmorpholin-2-yl)methoxy]phenyl]methanamine
SMILESCOc1ccc(CN)cc1OCC1CN(C)CCO1
InChIInChI=1S/C14H22N2O3/c1-16-5-6-18-12(9-16)10-19-14-7-11(8-15)3-4-13(14)17-2/h3-4,7,12H,5-6,8-10,15H2,1-2H3
InChIKeyFMRDOBUCNOVROB-UHFFFAOYSA-N
MW266.34 g/mol
LogP0.86
Rot. Bonds5

About [4-methoxy-3-[(4-methylmorpholin-2-yl)methoxy]phenyl]methanamine

[4-methoxy-3-[(4-methylmorpholin-2-yl)methoxy]phenyl]methanamine (PubChem CID 79166947) has the molecular formula C14H22N2O3 and a molecular weight of 266.34 g/mol. Its IUPAC name is [4-methoxy-3-[(4-methylmorpholin-2-yl)methoxy]phenyl]methanamine.

Molecular Properties

Compound Name[4-methoxy-3-[(4-methylmorpholin-2-yl)methoxy]phenyl]methanamine
PubChem CID79166947
Molecular FormulaC14H22N2O3
Molecular Weight266.34 g/mol
Exact Mass266.16
IUPAC Name[4-methoxy-3-[(4-methylmorpholin-2-yl)methoxy]phenyl]methanamine
SMILESCOc1ccc(CN)cc1OCC1CN(C)CCO1
InChIInChI=1S/C14H22N2O3/c1-16-5-6-18-12(9-16)10-19-14-7-11(8-15)3-4-13(14)17-2/h3-4,7,12H,5-6,8-10,15H2,1-2H3
InChIKeyFMRDOBUCNOVROB-UHFFFAOYSA-N
XLogP0.86
TPSA56.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 50.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-[4-methoxy-3-[(4-methylmorpholin-2-yl)methoxy]phenyl]-N-methylmethanamine
CID 79172273
1-[3-methoxy-4-[(4-methylmorpholin-2-yl)methoxy]phenyl]ethanamine
CID 79166369
[2-[(4-methylmorpholin-2-yl)methoxy]phenyl]methanamine
CID 79166937
2-[(2,4-dimethylphenoxy)methyl]-4-methylmorpholine
CID 79182676
[3-fluoro-4-[(4-methylmorpholin-2-yl)methoxy]phenyl]methanol
CID 107690789
[3-(cyclohexylmethoxy)-4-methoxyphenyl]methanamine
CID 43122515
4-methyl-3-[(4-methylmorpholin-2-yl)methoxy]benzenecarbothioamide
CID 107656463
[3-bromo-5-methoxy-4-[(4-methylmorpholin-2-yl)methoxy]phenyl]methanol
CID 79171963
1-[5-fluoro-2-[(4-methylmorpholin-2-yl)methoxy]phenyl]propan-2-amine
CID 107700818
3-chloro-4-[(4-methylmorpholin-2-yl)methoxy]benzenecarbothioamide
CID 79172491
1-[3-fluoro-4-[(4-methylmorpholin-2-yl)methoxy]phenyl]butan-2-amine
CID 107693270
(2S)-2-[(4-chloro-2-iodophenoxy)methyl]-4-methylmorpholine
CID 58005244

Frequently Asked Questions

What is the IUPAC name of [4-methoxy-3-[(4-methylmorpholin-2-yl)methoxy]phenyl]methanamine?
The IUPAC name of [4-methoxy-3-[(4-methylmorpholin-2-yl)methoxy]phenyl]methanamine (CID 79166947) is [4-methoxy-3-[(4-methylmorpholin-2-yl)methoxy]phenyl]methanamine.
What is the SMILES notation for [4-methoxy-3-[(4-methylmorpholin-2-yl)methoxy]phenyl]methanamine?
The canonical SMILES for [4-methoxy-3-[(4-methylmorpholin-2-yl)methoxy]phenyl]methanamine is COc1ccc(CN)cc1OCC1CN(C)CCO1.
What is the InChIKey of [4-methoxy-3-[(4-methylmorpholin-2-yl)methoxy]phenyl]methanamine?
The InChIKey is FMRDOBUCNOVROB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O3/c1-16-5-6-18-12(9-16)10-19-14-7-11(8-15)3-4-13(14)17-2/h3-4,7,12H,5-6,8-10,15H2,1-2H3.
What are the key properties of [4-methoxy-3-[(4-methylmorpholin-2-yl)methoxy]phenyl]methanamine?
[4-methoxy-3-[(4-methylmorpholin-2-yl)methoxy]phenyl]methanamine has a molecular weight of 266.34 g/mol, XLogP of 0.86, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-methoxy-3-[(4-methylmorpholin-2-yl)methoxy]phenyl]methanamine is sourced from PubChem (CID 79166947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).