2-methyl-N-[[3-(2-morpholin-4-ylethoxy)phenyl]methyl]propan-1-amine

C17H28N2O2 — CID 39400901

IUPAC2-methyl-N-[[3-(2-morpholin-4-ylethoxy)phenyl]methyl]propan-1-amine
SMILESCC(C)CNCc1cccc(OCCN2CCOCC2)c1
InChIInChI=1S/C17H28N2O2/c1-15(2)13-18-14-16-4-3-5-17(12-16)21-11-8-19-6-9-20-10-7-19/h3-5,12,15,18H,6-11,13-14H2,1-2H3
InChIKeyLTOJCAUPIIWWDF-UHFFFAOYSA-N
MW292.42 g/mol
LogP2.14
Rot. Bonds8

About 2-methyl-N-[[3-(2-morpholin-4-ylethoxy)phenyl]methyl]propan-1-amine

2-methyl-N-[[3-(2-morpholin-4-ylethoxy)phenyl]methyl]propan-1-amine (PubChem CID 39400901) has the molecular formula C17H28N2O2 and a molecular weight of 292.42 g/mol. Its IUPAC name is 2-methyl-N-[[3-(2-morpholin-4-ylethoxy)phenyl]methyl]propan-1-amine.

Molecular Properties

Compound Name2-methyl-N-[[3-(2-morpholin-4-ylethoxy)phenyl]methyl]propan-1-amine
PubChem CID39400901
Molecular FormulaC17H28N2O2
Molecular Weight292.42 g/mol
Exact Mass292.22
IUPAC Name2-methyl-N-[[3-(2-morpholin-4-ylethoxy)phenyl]methyl]propan-1-amine
SMILESCC(C)CNCc1cccc(OCCN2CCOCC2)c1
InChIInChI=1S/C17H28N2O2/c1-15(2)13-18-14-16-4-3-5-17(12-16)21-11-8-19-6-9-20-10-7-19/h3-5,12,15,18H,6-11,13-14H2,1-2H3
InChIKeyLTOJCAUPIIWWDF-UHFFFAOYSA-N
XLogP2.14
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.42
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-methyl-N-[[3-(2-thiomorpholin-4-ylethoxy)phenyl]methyl]propan-1-amine
CID 62418261
2-methyl-N-[[3-(3-pyrrolidin-1-ylpropoxy)phenyl]methyl]propan-1-amine
CID 63055726
3-amino-2-methyl-N-[[3-(2-morpholin-4-ylethoxy)phenyl]methyl]butanamide
CID 120503385
1-ethyl-3-(2-methylpropyl)-2-[[3-(2-morpholin-4-ylethoxy)phenyl]methyl]guanidine
CID 111180353
[3-(2-morpholin-4-ylethoxy)phenyl]methanol
CID 7164622
1-[3-(2-morpholin-4-ylethoxy)phenyl]ethanol
CID 43504270
N-[(1-tert-butyltriazol-4-yl)methyl]-1-[3-(2-morpholin-4-ylethoxy)phenyl]methanamine
CID 119047912
1-benzyl-3-[[3-(2-morpholin-4-ylethoxy)phenyl]methyl]urea
CID 47079982
(2S)-2-amino-N-[[3-(2-morpholin-4-ylethoxy)phenyl]methyl]butanamide;dihydrochloride
CID 119865316
1,2-dimethyl-3-[[3-(2-morpholin-4-ylethoxy)phenyl]methyl]guanidine;hydroiodide
CID 110918710
4-[3-[(2-morpholin-4-ylpropylamino)methyl]phenoxy]butanenitrile
CID 119108890
2-methyl-1-[[3-(2-morpholin-4-ylethoxy)phenyl]methyl]-3-(2-thiophen-3-ylpropyl)guanidine
CID 111703742

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[[3-(2-morpholin-4-ylethoxy)phenyl]methyl]propan-1-amine?
The IUPAC name of 2-methyl-N-[[3-(2-morpholin-4-ylethoxy)phenyl]methyl]propan-1-amine (CID 39400901) is 2-methyl-N-[[3-(2-morpholin-4-ylethoxy)phenyl]methyl]propan-1-amine.
What is the SMILES notation for 2-methyl-N-[[3-(2-morpholin-4-ylethoxy)phenyl]methyl]propan-1-amine?
The canonical SMILES for 2-methyl-N-[[3-(2-morpholin-4-ylethoxy)phenyl]methyl]propan-1-amine is CC(C)CNCc1cccc(OCCN2CCOCC2)c1.
What is the InChIKey of 2-methyl-N-[[3-(2-morpholin-4-ylethoxy)phenyl]methyl]propan-1-amine?
The InChIKey is LTOJCAUPIIWWDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2O2/c1-15(2)13-18-14-16-4-3-5-17(12-16)21-11-8-19-6-9-20-10-7-19/h3-5,12,15,18H,6-11,13-14H2,1-2H3.
What are the key properties of 2-methyl-N-[[3-(2-morpholin-4-ylethoxy)phenyl]methyl]propan-1-amine?
2-methyl-N-[[3-(2-morpholin-4-ylethoxy)phenyl]methyl]propan-1-amine has a molecular weight of 292.42 g/mol, XLogP of 2.14, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[[3-(2-morpholin-4-ylethoxy)phenyl]methyl]propan-1-amine is sourced from PubChem (CID 39400901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).