N-(3-acetylphenyl)-2-[2-(aminomethyl)phenyl]acetamide

C17H18N2O2 — CID 81313310

IUPACN-(3-acetylphenyl)-2-[2-(aminomethyl)phenyl]acetamide
SMILESCC(=O)c1cccc(NC(=O)Cc2ccccc2CN)c1
InChIInChI=1S/C17H18N2O2/c1-12(20)13-7-4-8-16(9-13)19-17(21)10-14-5-2-3-6-15(14)11-18/h2-9H,10-11,18H2,1H3,(H,19,21)
InChIKeyDNEVVPSSGCGBSY-UHFFFAOYSA-N
MW282.34 g/mol
LogP2.53
Rot. Bonds5

About N-(3-acetylphenyl)-2-[2-(aminomethyl)phenyl]acetamide

N-(3-acetylphenyl)-2-[2-(aminomethyl)phenyl]acetamide (PubChem CID 81313310) has the molecular formula C17H18N2O2 and a molecular weight of 282.34 g/mol. Its IUPAC name is N-(3-acetylphenyl)-2-[2-(aminomethyl)phenyl]acetamide.

Molecular Properties

Compound NameN-(3-acetylphenyl)-2-[2-(aminomethyl)phenyl]acetamide
PubChem CID81313310
Molecular FormulaC17H18N2O2
Molecular Weight282.34 g/mol
Exact Mass282.14
IUPAC NameN-(3-acetylphenyl)-2-[2-(aminomethyl)phenyl]acetamide
SMILESCC(=O)c1cccc(NC(=O)Cc2ccccc2CN)c1
InChIInChI=1S/C17H18N2O2/c1-12(20)13-7-4-8-16(9-13)19-17(21)10-14-5-2-3-6-15(14)11-18/h2-9H,10-11,18H2,1H3,(H,19,21)
InChIKeyDNEVVPSSGCGBSY-UHFFFAOYSA-N
XLogP2.53
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.34
LogP ≤ 52.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-[[2-[2-(aminomethyl)phenyl]acetyl]amino]benzamide
CID 81312309
N-(3-acetylphenyl)-2-(2-methoxyphenyl)acetamide
CID 2711452
2-[2-(aminomethyl)phenyl]-N-[3-(hydroxymethyl)phenyl]acetamide
CID 81318026
N-(3-acetylphenyl)-2-(4-phenylphenyl)acetamide
CID 972684
N-(3-acetylphenyl)propanamide
CID 903063
2-[2-(aminomethyl)phenyl]-N-(3-hydroxy-4-methylphenyl)acetamide
CID 107701531
N-(3-acetylphenyl)-2-naphthalen-2-ylacetamide
CID 9165110
3-[[2-[4-(aminomethyl)phenyl]acetyl]amino]benzamide
CID 107811064
N-(3-acetylphenyl)-2-(2-methoxy-4,5-dimethylphenyl)acetamide
CID 110767948
N'-(3-acetylphenyl)-N-benzylpropanediamide
CID 108945305
1-[3-[[3-(aminomethyl)-2-pyridinyl]amino]phenyl]ethanone
CID 82084693
[2-(3-acetylanilino)-2-oxoethyl]-[(2-chlorophenyl)methyl]-methylazanium
CID 9057793

Frequently Asked Questions

What is the IUPAC name of N-(3-acetylphenyl)-2-[2-(aminomethyl)phenyl]acetamide?
The IUPAC name of N-(3-acetylphenyl)-2-[2-(aminomethyl)phenyl]acetamide (CID 81313310) is N-(3-acetylphenyl)-2-[2-(aminomethyl)phenyl]acetamide.
What is the SMILES notation for N-(3-acetylphenyl)-2-[2-(aminomethyl)phenyl]acetamide?
The canonical SMILES for N-(3-acetylphenyl)-2-[2-(aminomethyl)phenyl]acetamide is CC(=O)c1cccc(NC(=O)Cc2ccccc2CN)c1.
What is the InChIKey of N-(3-acetylphenyl)-2-[2-(aminomethyl)phenyl]acetamide?
The InChIKey is DNEVVPSSGCGBSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O2/c1-12(20)13-7-4-8-16(9-13)19-17(21)10-14-5-2-3-6-15(14)11-18/h2-9H,10-11,18H2,1H3,(H,19,21).
What are the key properties of N-(3-acetylphenyl)-2-[2-(aminomethyl)phenyl]acetamide?
N-(3-acetylphenyl)-2-[2-(aminomethyl)phenyl]acetamide has a molecular weight of 282.34 g/mol, XLogP of 2.53, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetylphenyl)-2-[2-(aminomethyl)phenyl]acetamide is sourced from PubChem (CID 81313310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).