N-[3-(aminomethyl)phenyl]-2-phenoxyacetamide

C15H16N2O2 — CID 16781265

IUPACN-[3-(aminomethyl)phenyl]-2-phenoxyacetamide
SMILESNCc1cccc(NC(=O)COc2ccccc2)c1
InChIInChI=1S/C15H16N2O2/c16-10-12-5-4-6-13(9-12)17-15(18)11-19-14-7-2-1-3-8-14/h1-9H,10-11,16H2,(H,17,18)
InChIKeyYBMFFBLDFSBGHW-UHFFFAOYSA-N
MW256.31 g/mol
LogP2.16
Rot. Bonds5

About N-[3-(aminomethyl)phenyl]-2-phenoxyacetamide

N-[3-(aminomethyl)phenyl]-2-phenoxyacetamide (PubChem CID 16781265) has the molecular formula C15H16N2O2 and a molecular weight of 256.31 g/mol. Its IUPAC name is N-[3-(aminomethyl)phenyl]-2-phenoxyacetamide.

Molecular Properties

Compound NameN-[3-(aminomethyl)phenyl]-2-phenoxyacetamide
PubChem CID16781265
Molecular FormulaC15H16N2O2
Molecular Weight256.31 g/mol
Exact Mass256.12
IUPAC NameN-[3-(aminomethyl)phenyl]-2-phenoxyacetamide
SMILESNCc1cccc(NC(=O)COc2ccccc2)c1
InChIInChI=1S/C15H16N2O2/c16-10-12-5-4-6-13(9-12)17-15(18)11-19-14-7-2-1-3-8-14/h1-9H,10-11,16H2,(H,17,18)
InChIKeyYBMFFBLDFSBGHW-UHFFFAOYSA-N
XLogP2.16
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.31
LogP ≤ 52.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-(aminomethyl)phenyl]-2-(3-fluorophenoxy)acetamide
CID 16784462
N-[3-(aminomethyl)phenyl]-2-(3-methylphenoxy)acetamide
CID 16783753
2-[3-(aminomethyl)phenoxy]-N-(4-phenoxyphenyl)acetamide
CID 46741579
2-[4-(aminomethyl)phenoxy]-N-(3-methoxyphenyl)acetamide
CID 16795321
3-[(2-phenoxyacetyl)amino]benzamide
CID 910367
N-[3-[(2-bromoacetyl)amino]phenyl]-2-phenoxyacetamide
CID 46736695
N-[3-[[2-(4-methoxyphenoxy)acetyl]amino]phenyl]-2-phenoxyacetamide
CID 17231339
3-[3-(aminomethyl)phenoxy]-N-phenylpropanamide
CID 106485112
2-phenylethyl 4-oxo-4-[3-[(2-phenoxyacetyl)amino]anilino]butanoate
CID 17231357
2-[3-(aminomethyl)phenoxy]-N-(3-chloro-4-fluorophenyl)acetamide
CID 106485098
[3-[(2-phenoxyacetyl)amino]phenyl] acetate
CID 6472442
N-[3-(aminomethyl)phenyl]-2-[(3-methoxyphenyl)methoxy]acetamide
CID 43823143

Frequently Asked Questions

What is the IUPAC name of N-[3-(aminomethyl)phenyl]-2-phenoxyacetamide?
The IUPAC name of N-[3-(aminomethyl)phenyl]-2-phenoxyacetamide (CID 16781265) is N-[3-(aminomethyl)phenyl]-2-phenoxyacetamide.
What is the SMILES notation for N-[3-(aminomethyl)phenyl]-2-phenoxyacetamide?
The canonical SMILES for N-[3-(aminomethyl)phenyl]-2-phenoxyacetamide is NCc1cccc(NC(=O)COc2ccccc2)c1.
What is the InChIKey of N-[3-(aminomethyl)phenyl]-2-phenoxyacetamide?
The InChIKey is YBMFFBLDFSBGHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O2/c16-10-12-5-4-6-13(9-12)17-15(18)11-19-14-7-2-1-3-8-14/h1-9H,10-11,16H2,(H,17,18).
What are the key properties of N-[3-(aminomethyl)phenyl]-2-phenoxyacetamide?
N-[3-(aminomethyl)phenyl]-2-phenoxyacetamide has a molecular weight of 256.31 g/mol, XLogP of 2.16, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(aminomethyl)phenyl]-2-phenoxyacetamide is sourced from PubChem (CID 16781265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).