1-[3-methoxy-2-[(4-methylmorpholin-2-yl)methoxy]phenyl]propan-2-amine

C16H26N2O3 — CID 79172506

IUPAC1-[3-methoxy-2-[(4-methylmorpholin-2-yl)methoxy]phenyl]propan-2-amine
SMILESCOc1cccc(CC(C)N)c1OCC1CN(C)CCO1
InChIInChI=1S/C16H26N2O3/c1-12(17)9-13-5-4-6-15(19-3)16(13)21-11-14-10-18(2)7-8-20-14/h4-6,12,14H,7-11,17H2,1-3H3
InChIKeyLDSMGIMWFHDKEQ-UHFFFAOYSA-N
MW294.39 g/mol
LogP1.29
Rot. Bonds6

About 1-[3-methoxy-2-[(4-methylmorpholin-2-yl)methoxy]phenyl]propan-2-amine

1-[3-methoxy-2-[(4-methylmorpholin-2-yl)methoxy]phenyl]propan-2-amine (PubChem CID 79172506) has the molecular formula C16H26N2O3 and a molecular weight of 294.39 g/mol. Its IUPAC name is 1-[3-methoxy-2-[(4-methylmorpholin-2-yl)methoxy]phenyl]propan-2-amine.

Molecular Properties

Compound Name1-[3-methoxy-2-[(4-methylmorpholin-2-yl)methoxy]phenyl]propan-2-amine
PubChem CID79172506
Molecular FormulaC16H26N2O3
Molecular Weight294.39 g/mol
Exact Mass294.19
IUPAC Name1-[3-methoxy-2-[(4-methylmorpholin-2-yl)methoxy]phenyl]propan-2-amine
SMILESCOc1cccc(CC(C)N)c1OCC1CN(C)CCO1
InChIInChI=1S/C16H26N2O3/c1-12(17)9-13-5-4-6-15(19-3)16(13)21-11-14-10-18(2)7-8-20-14/h4-6,12,14H,7-11,17H2,1-3H3
InChIKeyLDSMGIMWFHDKEQ-UHFFFAOYSA-N
XLogP1.29
TPSA56.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.39
LogP ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-[3-methoxy-2-(oxolan-2-ylmethoxy)phenyl]propan-2-amine
CID 60907628
1-[5-fluoro-2-[(4-methylmorpholin-2-yl)methoxy]phenyl]propan-2-amine
CID 107700818
1-[5-bromo-2-[(4-methylmorpholin-2-yl)methoxy]phenyl]propan-2-amine
CID 79182209
1-[3-bromo-2-[(4-methylmorpholin-2-yl)methoxy]phenyl]butan-2-amine
CID 79171162
[2-[(4-methylmorpholin-2-yl)methoxy]phenyl]methanamine
CID 79166937
1-[3-methoxy-4-[(4-methylmorpholin-2-yl)methoxy]phenyl]ethanamine
CID 79166369
[3-chloro-2-[(4-methylmorpholin-2-yl)methoxy]phenyl]methanamine
CID 112607579
1-[5-fluoro-2-[(4-methylmorpholin-2-yl)methoxy]phenyl]butan-2-amine
CID 107701365
2-methyl-6-[(4-methylmorpholin-2-yl)methoxy]aniline
CID 79165775
1-[3-methoxy-2-(3-methylbutoxy)phenyl]propan-2-amine
CID 60907892
[3-chloro-2-[(4-methylmorpholin-2-yl)methoxy]phenyl]methanol
CID 112612743
N-[[2-[(4-methylmorpholin-2-yl)methoxy]phenyl]methyl]cyclopropanamine
CID 79171206

Frequently Asked Questions

What is the IUPAC name of 1-[3-methoxy-2-[(4-methylmorpholin-2-yl)methoxy]phenyl]propan-2-amine?
The IUPAC name of 1-[3-methoxy-2-[(4-methylmorpholin-2-yl)methoxy]phenyl]propan-2-amine (CID 79172506) is 1-[3-methoxy-2-[(4-methylmorpholin-2-yl)methoxy]phenyl]propan-2-amine.
What is the SMILES notation for 1-[3-methoxy-2-[(4-methylmorpholin-2-yl)methoxy]phenyl]propan-2-amine?
The canonical SMILES for 1-[3-methoxy-2-[(4-methylmorpholin-2-yl)methoxy]phenyl]propan-2-amine is COc1cccc(CC(C)N)c1OCC1CN(C)CCO1.
What is the InChIKey of 1-[3-methoxy-2-[(4-methylmorpholin-2-yl)methoxy]phenyl]propan-2-amine?
The InChIKey is LDSMGIMWFHDKEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O3/c1-12(17)9-13-5-4-6-15(19-3)16(13)21-11-14-10-18(2)7-8-20-14/h4-6,12,14H,7-11,17H2,1-3H3.
What are the key properties of 1-[3-methoxy-2-[(4-methylmorpholin-2-yl)methoxy]phenyl]propan-2-amine?
1-[3-methoxy-2-[(4-methylmorpholin-2-yl)methoxy]phenyl]propan-2-amine has a molecular weight of 294.39 g/mol, XLogP of 1.29, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-methoxy-2-[(4-methylmorpholin-2-yl)methoxy]phenyl]propan-2-amine is sourced from PubChem (CID 79172506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).