N-[4-[[(4-ethylmorpholin-2-yl)methylamino]methyl]phenyl]acetamide

C16H25N3O2 — CID 115616524

IUPACN-[4-[[(4-ethylmorpholin-2-yl)methylamino]methyl]phenyl]acetamide
SMILESCCN1CCOC(CNCc2ccc(NC(C)=O)cc2)C1
InChIInChI=1S/C16H25N3O2/c1-3-19-8-9-21-16(12-19)11-17-10-14-4-6-15(7-5-14)18-13(2)20/h4-7,16-17H,3,8-12H2,1-2H3,(H,18,20)
InChIKeyJPESWHBFRLYPDP-UHFFFAOYSA-N
MW291.40 g/mol
LogP1.46
Rot. Bonds6

About N-[4-[[(4-ethylmorpholin-2-yl)methylamino]methyl]phenyl]acetamide

N-[4-[[(4-ethylmorpholin-2-yl)methylamino]methyl]phenyl]acetamide (PubChem CID 115616524) has the molecular formula C16H25N3O2 and a molecular weight of 291.40 g/mol. Its IUPAC name is N-[4-[[(4-ethylmorpholin-2-yl)methylamino]methyl]phenyl]acetamide.

Molecular Properties

Compound NameN-[4-[[(4-ethylmorpholin-2-yl)methylamino]methyl]phenyl]acetamide
PubChem CID115616524
Molecular FormulaC16H25N3O2
Molecular Weight291.40 g/mol
Exact Mass291.19
IUPAC NameN-[4-[[(4-ethylmorpholin-2-yl)methylamino]methyl]phenyl]acetamide
SMILESCCN1CCOC(CNCc2ccc(NC(C)=O)cc2)C1
InChIInChI=1S/C16H25N3O2/c1-3-19-8-9-21-16(12-19)11-17-10-14-4-6-15(7-5-14)18-13(2)20/h4-7,16-17H,3,8-12H2,1-2H3,(H,18,20)
InChIKeyJPESWHBFRLYPDP-UHFFFAOYSA-N
XLogP1.46
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.40
LogP ≤ 51.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-[[[(2S)-4-(2-methylpropyl)morpholin-2-yl]methylamino]methyl]phenyl]acetamide
CID 9268036
4-[[(4-ethylmorpholin-2-yl)methylamino]methyl]benzoic acid
CID 114399651
1-(4-ethylmorpholin-2-yl)-N-[[4-(methoxymethyl)phenyl]methyl]methanamine
CID 115653577
1-(4-ethylmorpholin-2-yl)-N-[(4-nitrophenyl)methyl]methanamine
CID 78946835
2-[(4-ethylmorpholin-2-yl)methylamino]-N-(4-fluorophenyl)acetamide
CID 115626310
3-[[(4-ethylmorpholin-2-yl)methylamino]methyl]benzoic acid
CID 103267262
1-(4-ethylmorpholin-2-yl)-N-[(1-ethylpyrrol-3-yl)methyl]methanamine
CID 114399548
[5-[[(4-ethylmorpholin-2-yl)methylamino]methyl]furan-2-yl]methanol
CID 115653583
1-(4-ethylmorpholin-2-yl)-N-[(4-prop-2-enoxyphenyl)methyl]methanamine
CID 115616594
4-[[(4-ethylmorpholin-2-yl)methylamino]methyl]-2-methoxyphenol
CID 114399658
1-(4-ethylmorpholin-2-yl)-N-[(1-methyl-2,3-dihydroindol-5-yl)methyl]methanamine
CID 115756743
2-[[(4-ethylmorpholin-2-yl)methylamino]methyl]benzamide
CID 114399817

Frequently Asked Questions

What is the IUPAC name of N-[4-[[(4-ethylmorpholin-2-yl)methylamino]methyl]phenyl]acetamide?
The IUPAC name of N-[4-[[(4-ethylmorpholin-2-yl)methylamino]methyl]phenyl]acetamide (CID 115616524) is N-[4-[[(4-ethylmorpholin-2-yl)methylamino]methyl]phenyl]acetamide.
What is the SMILES notation for N-[4-[[(4-ethylmorpholin-2-yl)methylamino]methyl]phenyl]acetamide?
The canonical SMILES for N-[4-[[(4-ethylmorpholin-2-yl)methylamino]methyl]phenyl]acetamide is CCN1CCOC(CNCc2ccc(NC(C)=O)cc2)C1.
What is the InChIKey of N-[4-[[(4-ethylmorpholin-2-yl)methylamino]methyl]phenyl]acetamide?
The InChIKey is JPESWHBFRLYPDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O2/c1-3-19-8-9-21-16(12-19)11-17-10-14-4-6-15(7-5-14)18-13(2)20/h4-7,16-17H,3,8-12H2,1-2H3,(H,18,20).
What are the key properties of N-[4-[[(4-ethylmorpholin-2-yl)methylamino]methyl]phenyl]acetamide?
N-[4-[[(4-ethylmorpholin-2-yl)methylamino]methyl]phenyl]acetamide has a molecular weight of 291.40 g/mol, XLogP of 1.46, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[[(4-ethylmorpholin-2-yl)methylamino]methyl]phenyl]acetamide is sourced from PubChem (CID 115616524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).