N-[3-(aminomethyl)phenyl]-2-morpholin-4-ylacetamide

C13H19N3O2 — CID 16779234

IUPACN-[3-(aminomethyl)phenyl]-2-morpholin-4-ylacetamide
SMILESNCc1cccc(NC(=O)CN2CCOCC2)c1
InChIInChI=1S/C13H19N3O2/c14-9-11-2-1-3-12(8-11)15-13(17)10-16-4-6-18-7-5-16/h1-3,8H,4-7,9-10,14H2,(H,15,17)
InChIKeyCWBRYYNDWUGPOU-UHFFFAOYSA-N
MW249.31 g/mol
LogP0.42
Rot. Bonds4

About N-[3-(aminomethyl)phenyl]-2-morpholin-4-ylacetamide

N-[3-(aminomethyl)phenyl]-2-morpholin-4-ylacetamide (PubChem CID 16779234) has the molecular formula C13H19N3O2 and a molecular weight of 249.31 g/mol. Its IUPAC name is N-[3-(aminomethyl)phenyl]-2-morpholin-4-ylacetamide.

Molecular Properties

Compound NameN-[3-(aminomethyl)phenyl]-2-morpholin-4-ylacetamide
PubChem CID16779234
Molecular FormulaC13H19N3O2
Molecular Weight249.31 g/mol
Exact Mass249.15
IUPAC NameN-[3-(aminomethyl)phenyl]-2-morpholin-4-ylacetamide
SMILESNCc1cccc(NC(=O)CN2CCOCC2)c1
InChIInChI=1S/C13H19N3O2/c14-9-11-2-1-3-12(8-11)15-13(17)10-16-4-6-18-7-5-16/h1-3,8H,4-7,9-10,14H2,(H,15,17)
InChIKeyCWBRYYNDWUGPOU-UHFFFAOYSA-N
XLogP0.42
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 ≤ 50.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[3-(aminomethyl)phenyl]-2-morpholin-4-ylacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[3-(aminomethyl)phenyl]-2-pyrrolidin-1-ylacetamide
CID 16779298
N-[3-(aminomethyl)phenyl]-2-(4-hydroxypiperidin-1-yl)acetamide
CID 16786515
N-[3-(aminomethyl)phenyl]-2-(4-cyclopropylpiperazin-1-yl)acetamide
CID 61440797
N-[3-(dimethylamino)phenyl]-2-morpholin-4-ylacetamide
CID 110483400
2-[13-(2-anilino-2-oxoethyl)-1,4,10-trioxa-7,13-diazacyclopentadec-7-yl]-N-phenylacetamide
CID 649229
3-amino-N-[4-[(2-morpholin-4-ylacetyl)amino]phenyl]propanamide;dihydrochloride
CID 119840811
2-(3-fluorophenyl)-N-[4-[(2-morpholin-4-ylacetyl)amino]phenyl]acetamide
CID 51327223
N-[3-(aminomethyl)phenyl]-2-(3,4-dimethoxypyrrolidin-1-yl)acetamide
CID 103531213
4-chloro-N-[3-[(2-morpholin-4-ylacetyl)amino]phenyl]benzamide
CID 50875747
N-[3-(aminomethyl)phenyl]-3-(2,2-dimethylmorpholin-4-yl)propanamide
CID 43592491
2-(3-methylpyrazol-1-yl)-N-[3-(morpholin-4-ylmethyl)phenyl]acetamide
CID 19516890
N-[4-(aminomethyl)phenyl]-3-morpholin-4-ylpropanamide
CID 16779088

Frequently Asked Questions

What is the IUPAC name of N-[3-(aminomethyl)phenyl]-2-morpholin-4-ylacetamide?
The IUPAC name of N-[3-(aminomethyl)phenyl]-2-morpholin-4-ylacetamide (CID 16779234) is N-[3-(aminomethyl)phenyl]-2-morpholin-4-ylacetamide.
What is the SMILES notation for N-[3-(aminomethyl)phenyl]-2-morpholin-4-ylacetamide?
The canonical SMILES for N-[3-(aminomethyl)phenyl]-2-morpholin-4-ylacetamide is NCc1cccc(NC(=O)CN2CCOCC2)c1.
What is the InChIKey of N-[3-(aminomethyl)phenyl]-2-morpholin-4-ylacetamide?
The InChIKey is CWBRYYNDWUGPOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O2/c14-9-11-2-1-3-12(8-11)15-13(17)10-16-4-6-18-7-5-16/h1-3,8H,4-7,9-10,14H2,(H,15,17).
What are the key properties of N-[3-(aminomethyl)phenyl]-2-morpholin-4-ylacetamide?
N-[3-(aminomethyl)phenyl]-2-morpholin-4-ylacetamide has a molecular weight of 249.31 g/mol, XLogP of 0.42, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(aminomethyl)phenyl]-2-morpholin-4-ylacetamide is sourced from PubChem (CID 16779234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).