1-[3-[2-(2,2-dimethylmorpholin-4-yl)ethoxy]phenyl]-N-methylmethanamine

C16H26N2O2 — CID 62432960

IUPAC1-[3-[2-(2,2-dimethylmorpholin-4-yl)ethoxy]phenyl]-N-methylmethanamine
SMILESCNCc1cccc(OCCN2CCOC(C)(C)C2)c1
InChIInChI=1S/C16H26N2O2/c1-16(2)13-18(8-10-20-16)7-9-19-15-6-4-5-14(11-15)12-17-3/h4-6,11,17H,7-10,12-13H2,1-3H3
InChIKeyMYPJKGFFZCJFPC-UHFFFAOYSA-N
MW278.40 g/mol
LogP1.90
Rot. Bonds6

About 1-[3-[2-(2,2-dimethylmorpholin-4-yl)ethoxy]phenyl]-N-methylmethanamine

1-[3-[2-(2,2-dimethylmorpholin-4-yl)ethoxy]phenyl]-N-methylmethanamine (PubChem CID 62432960) has the molecular formula C16H26N2O2 and a molecular weight of 278.40 g/mol. Its IUPAC name is 1-[3-[2-(2,2-dimethylmorpholin-4-yl)ethoxy]phenyl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[3-[2-(2,2-dimethylmorpholin-4-yl)ethoxy]phenyl]-N-methylmethanamine
PubChem CID62432960
Molecular FormulaC16H26N2O2
Molecular Weight278.40 g/mol
Exact Mass278.20
IUPAC Name1-[3-[2-(2,2-dimethylmorpholin-4-yl)ethoxy]phenyl]-N-methylmethanamine
SMILESCNCc1cccc(OCCN2CCOC(C)(C)C2)c1
InChIInChI=1S/C16H26N2O2/c1-16(2)13-18(8-10-20-16)7-9-19-15-6-4-5-14(11-15)12-17-3/h4-6,11,17H,7-10,12-13H2,1-3H3
InChIKeyMYPJKGFFZCJFPC-UHFFFAOYSA-N
XLogP1.90
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-[2-(2,2-dimethylmorpholin-4-yl)ethoxy]benzoic acid
CID 43593001
1-[3-[2-(3-methoxy-3-methylpiperidin-1-yl)ethoxy]phenyl]-N-methylmethanamine
CID 107395570
1-[3-[2-(4-ethylpiperazin-1-yl)ethoxy]phenyl]-N-methylmethanamine
CID 62419745
3-[3-(2,2-dimethylmorpholin-4-yl)propoxy]benzoic acid
CID 63068123
1-[3-[2-[3-(methoxymethyl)pyrrolidin-1-yl]ethoxy]phenyl]-N-methylmethanamine
CID 64583405
N-[(3-butoxyphenyl)methyl]-2,2-dimethylmorpholine-4-carboxamide
CID 87004150
4-[2-(2,2-dimethylmorpholin-4-yl)ethoxy]benzoic acid
CID 43592997
2-methyl-N-[[3-(2-morpholin-4-ylethoxy)phenyl]methyl]propan-1-amine
CID 39400901
1-benzyl-3-[[3-(2-morpholin-4-ylethoxy)phenyl]methyl]urea
CID 47079982
N-methyl-2-[3-[2-(7-methyl-2,7-diazaspiro[3.4]octan-2-yl)ethoxy]phenyl]ethanamine
CID 170714096
N-methyl-1-[3-[2-(1-methylpyrazol-4-yl)oxyethoxy]phenyl]methanamine
CID 116793642
1-[3-[2-(2,4-dimethylpiperidin-1-yl)ethoxy]phenyl]-N-methylmethanamine
CID 62430706

Frequently Asked Questions

What is the IUPAC name of 1-[3-[2-(2,2-dimethylmorpholin-4-yl)ethoxy]phenyl]-N-methylmethanamine?
The IUPAC name of 1-[3-[2-(2,2-dimethylmorpholin-4-yl)ethoxy]phenyl]-N-methylmethanamine (CID 62432960) is 1-[3-[2-(2,2-dimethylmorpholin-4-yl)ethoxy]phenyl]-N-methylmethanamine.
What is the SMILES notation for 1-[3-[2-(2,2-dimethylmorpholin-4-yl)ethoxy]phenyl]-N-methylmethanamine?
The canonical SMILES for 1-[3-[2-(2,2-dimethylmorpholin-4-yl)ethoxy]phenyl]-N-methylmethanamine is CNCc1cccc(OCCN2CCOC(C)(C)C2)c1.
What is the InChIKey of 1-[3-[2-(2,2-dimethylmorpholin-4-yl)ethoxy]phenyl]-N-methylmethanamine?
The InChIKey is MYPJKGFFZCJFPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O2/c1-16(2)13-18(8-10-20-16)7-9-19-15-6-4-5-14(11-15)12-17-3/h4-6,11,17H,7-10,12-13H2,1-3H3.
What are the key properties of 1-[3-[2-(2,2-dimethylmorpholin-4-yl)ethoxy]phenyl]-N-methylmethanamine?
1-[3-[2-(2,2-dimethylmorpholin-4-yl)ethoxy]phenyl]-N-methylmethanamine has a molecular weight of 278.40 g/mol, XLogP of 1.90, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-[2-(2,2-dimethylmorpholin-4-yl)ethoxy]phenyl]-N-methylmethanamine is sourced from PubChem (CID 62432960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).