2-[2-(aminomethyl)morpholin-4-yl]-N-phenylacetamide

C13H19N3O2 — CID 61336829

IUPAC2-[2-(aminomethyl)morpholin-4-yl]-N-phenylacetamide
SMILESNCC1CN(CC(=O)Nc2ccccc2)CCO1
InChIInChI=1S/C13H19N3O2/c14-8-12-9-16(6-7-18-12)10-13(17)15-11-4-2-1-3-5-11/h1-5,12H,6-10,14H2,(H,15,17)
InChIKeyDXFRSVOBQNHXCJ-UHFFFAOYSA-N
MW249.31 g/mol
LogP0.28
Rot. Bonds4

About 2-[2-(aminomethyl)morpholin-4-yl]-N-phenylacetamide

2-[2-(aminomethyl)morpholin-4-yl]-N-phenylacetamide (PubChem CID 61336829) has the molecular formula C13H19N3O2 and a molecular weight of 249.31 g/mol. Its IUPAC name is 2-[2-(aminomethyl)morpholin-4-yl]-N-phenylacetamide.

Molecular Properties

Compound Name2-[2-(aminomethyl)morpholin-4-yl]-N-phenylacetamide
PubChem CID61336829
Molecular FormulaC13H19N3O2
Molecular Weight249.31 g/mol
Exact Mass249.15
IUPAC Name2-[2-(aminomethyl)morpholin-4-yl]-N-phenylacetamide
SMILESNCC1CN(CC(=O)Nc2ccccc2)CCO1
InChIInChI=1S/C13H19N3O2/c14-8-12-9-16(6-7-18-12)10-13(17)15-11-4-2-1-3-5-11/h1-5,12H,6-10,14H2,(H,15,17)
InChIKeyDXFRSVOBQNHXCJ-UHFFFAOYSA-N
XLogP0.28
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.31
LogP ≤ 50.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[2-(aminomethyl)morpholin-4-yl]-N-(3-propan-2-ylphenyl)acetamide
CID 114394898
2-[2-(aminomethyl)morpholin-4-yl]-N-(2-bromophenyl)acetamide
CID 114394940
4-[[2-[2-(hydroxymethyl)morpholin-4-yl]acetyl]amino]benzamide
CID 79834650
2-[2-(aminomethyl)morpholin-4-yl]-N-(3-chloro-4-cyanophenyl)acetamide
CID 114398812
4-[2-oxo-2-(4-phenylanilino)ethyl]morpholine-2-carboxamide
CID 49451499
2-[4-[2-(4-chloroanilino)-2-oxoethyl]morpholin-2-yl]acetic acid
CID 66433081
2-[2-(aminomethyl)morpholin-4-yl]-N-methylacetamide
CID 61336632
2-[2-(aminomethyl)morpholin-4-yl]-N-(4-chloro-2-methylphenyl)acetamide
CID 114395086
2-[4-[2-(3-iodoanilino)-2-oxoethyl]morpholin-2-yl]acetic acid
CID 66434673
N-(4-carbamothioylphenyl)-2-(2-ethylmorpholin-4-yl)acetamide
CID 43562692
[4-(2-phenylprop-2-enyl)morpholin-2-yl]methanamine
CID 114399002
2-[2-(aminomethyl)morpholin-4-yl]-N-(4-chloro-2-fluorophenyl)acetamide
CID 114394862

Frequently Asked Questions

What is the IUPAC name of 2-[2-(aminomethyl)morpholin-4-yl]-N-phenylacetamide?
The IUPAC name of 2-[2-(aminomethyl)morpholin-4-yl]-N-phenylacetamide (CID 61336829) is 2-[2-(aminomethyl)morpholin-4-yl]-N-phenylacetamide.
What is the SMILES notation for 2-[2-(aminomethyl)morpholin-4-yl]-N-phenylacetamide?
The canonical SMILES for 2-[2-(aminomethyl)morpholin-4-yl]-N-phenylacetamide is NCC1CN(CC(=O)Nc2ccccc2)CCO1.
What is the InChIKey of 2-[2-(aminomethyl)morpholin-4-yl]-N-phenylacetamide?
The InChIKey is DXFRSVOBQNHXCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O2/c14-8-12-9-16(6-7-18-12)10-13(17)15-11-4-2-1-3-5-11/h1-5,12H,6-10,14H2,(H,15,17).
What are the key properties of 2-[2-(aminomethyl)morpholin-4-yl]-N-phenylacetamide?
2-[2-(aminomethyl)morpholin-4-yl]-N-phenylacetamide has a molecular weight of 249.31 g/mol, XLogP of 0.28, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(aminomethyl)morpholin-4-yl]-N-phenylacetamide is sourced from PubChem (CID 61336829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).