2-[2-(aminomethyl)phenyl]-N-(2,3-dimethylphenyl)acetamide

C17H20N2O — CID 81317941

IUPAC2-[2-(aminomethyl)phenyl]-N-(2,3-dimethylphenyl)acetamide
SMILESCc1cccc(NC(=O)Cc2ccccc2CN)c1C
InChIInChI=1S/C17H20N2O/c1-12-6-5-9-16(13(12)2)19-17(20)10-14-7-3-4-8-15(14)11-18/h3-9H,10-11,18H2,1-2H3,(H,19,20)
InChIKeySCDMILDCSBAIDA-UHFFFAOYSA-N
MW268.36 g/mol
LogP2.94
Rot. Bonds4

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

2-[2-(aminomethyl)phenyl]-N-(2,3-dimethylphenyl)acetamide (PubChem CID 81317941) has the molecular formula C17H20N2O and a molecular weight of 268.36 g/mol. Its IUPAC name is 2-[2-(aminomethyl)phenyl]-N-(2,3-dimethylphenyl)acetamide.

Molecular Properties

Compound Name2-[2-(aminomethyl)phenyl]-N-(2,3-dimethylphenyl)acetamide
PubChem CID81317941
Molecular FormulaC17H20N2O
Molecular Weight268.36 g/mol
Exact Mass268.16
IUPAC Name2-[2-(aminomethyl)phenyl]-N-(2,3-dimethylphenyl)acetamide
SMILESCc1cccc(NC(=O)Cc2ccccc2CN)c1C
InChIInChI=1S/C17H20N2O/c1-12-6-5-9-16(13(12)2)19-17(20)10-14-7-3-4-8-15(14)11-18/h3-9H,10-11,18H2,1-2H3,(H,19,20)
InChIKeySCDMILDCSBAIDA-UHFFFAOYSA-N
XLogP2.94
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 52.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-aminophenyl)-N-(2,3-dimethylphenyl)acetamide
CID 16794842
N-(2,3-dimethylphenyl)-2-naphthalen-1-ylacetamide
CID 1228165
N-(2,3-dimethylphenyl)-2-(2-methylsulfonylphenyl)acetamide
CID 110439313
N-(3-acetamido-2-methylphenyl)-2-(2-methylphenyl)acetamide
CID 39975983
2-(2-methylphenyl)-N-[2-[[2-(2-methylphenyl)acetyl]amino]phenyl]acetamide
CID 26164464
N,N'-bis(2,3-dimethylphenyl)butanediamide
CID 4250073
N-(2,3-dimethylphenyl)-2-pyridin-2-ylacetamide
CID 110696972
N-(2,3-dimethylphenyl)-2-hydroxyacetamide
CID 16769655
2-[2-(aminomethyl)phenyl]-N-(3-bromo-2-hydroxyphenyl)acetamide
CID 81499893
N-(2,3-dimethylphenyl)-2-(3,4-dimethylphenyl)acetamide
CID 2599603
N-[(2-chlorophenyl)methyl]-N'-(2,3-dimethylphenyl)propanediamide
CID 108946597
2-(benzylamino)-N-(2,3-dimethylphenyl)acetamide
CID 54813873

Frequently Asked Questions

What is the IUPAC name of 2-[2-(aminomethyl)phenyl]-N-(2,3-dimethylphenyl)acetamide?
The IUPAC name of 2-[2-(aminomethyl)phenyl]-N-(2,3-dimethylphenyl)acetamide (CID 81317941) is 2-[2-(aminomethyl)phenyl]-N-(2,3-dimethylphenyl)acetamide.
What is the SMILES notation for 2-[2-(aminomethyl)phenyl]-N-(2,3-dimethylphenyl)acetamide?
The canonical SMILES for 2-[2-(aminomethyl)phenyl]-N-(2,3-dimethylphenyl)acetamide is Cc1cccc(NC(=O)Cc2ccccc2CN)c1C.
What is the InChIKey of 2-[2-(aminomethyl)phenyl]-N-(2,3-dimethylphenyl)acetamide?
The InChIKey is SCDMILDCSBAIDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O/c1-12-6-5-9-16(13(12)2)19-17(20)10-14-7-3-4-8-15(14)11-18/h3-9H,10-11,18H2,1-2H3,(H,19,20).
What are the key properties of 2-[2-(aminomethyl)phenyl]-N-(2,3-dimethylphenyl)acetamide?
2-[2-(aminomethyl)phenyl]-N-(2,3-dimethylphenyl)acetamide has a molecular weight of 268.36 g/mol, XLogP of 2.94, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(aminomethyl)phenyl]-N-(2,3-dimethylphenyl)acetamide is sourced from PubChem (CID 81317941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).