N-[3-(methylaminomethyl)phenyl]-2-(3-methylphenyl)acetamide

C17H20N2O — CID 62388896

IUPACN-[3-(methylaminomethyl)phenyl]-2-(3-methylphenyl)acetamide
SMILESCNCc1cccc(NC(=O)Cc2cccc(C)c2)c1
InChIInChI=1S/C17H20N2O/c1-13-5-3-6-14(9-13)11-17(20)19-16-8-4-7-15(10-16)12-18-2/h3-10,18H,11-12H2,1-2H3,(H,19,20)
InChIKeyPIQILTSPHFSOHK-UHFFFAOYSA-N
MW268.36 g/mol
LogP2.90
Rot. Bonds5

About N-[3-(methylaminomethyl)phenyl]-2-(3-methylphenyl)acetamide

N-[3-(methylaminomethyl)phenyl]-2-(3-methylphenyl)acetamide (PubChem CID 62388896) has the molecular formula C17H20N2O and a molecular weight of 268.36 g/mol. Its IUPAC name is N-[3-(methylaminomethyl)phenyl]-2-(3-methylphenyl)acetamide.

Molecular Properties

Compound NameN-[3-(methylaminomethyl)phenyl]-2-(3-methylphenyl)acetamide
PubChem CID62388896
Molecular FormulaC17H20N2O
Molecular Weight268.36 g/mol
Exact Mass268.16
IUPAC NameN-[3-(methylaminomethyl)phenyl]-2-(3-methylphenyl)acetamide
SMILESCNCc1cccc(NC(=O)Cc2cccc(C)c2)c1
InChIInChI=1S/C17H20N2O/c1-13-5-3-6-14(9-13)11-17(20)19-16-8-4-7-15(10-16)12-18-2/h3-10,18H,11-12H2,1-2H3,(H,19,20)
InChIKeyPIQILTSPHFSOHK-UHFFFAOYSA-N
XLogP2.90
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 52.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-methylphenyl)-N-phenylacetamide
CID 6470005
N-(3-chlorophenyl)-2-(3-methylphenyl)acetamide
CID 9497443
2-cyano-N-[3-[[2-(3-methylphenyl)acetyl]amino]phenyl]acetamide
CID 108922788
N-(3,5-dimethylphenyl)-2-(3-methylphenyl)acetamide
CID 11839743
3-[[2-(3-methylphenyl)acetyl]amino]benzoic acid
CID 17127022
2-(2,5-difluorophenyl)-N-[3-(methylaminomethyl)phenyl]acetamide
CID 84589209
4-hydroxy-N-[3-(methylaminomethyl)phenyl]pentanamide
CID 79192534
N-[3-(N-hydroxy-C-methylcarbonimidoyl)phenyl]-2-(3-methylphenyl)acetamide
CID 76942761
2-ethoxy-N-[3-(methylaminomethyl)phenyl]acetamide;hydrochloride
CID 119441041
N-[3-(methylaminomethyl)phenyl]-3-methylsulfonylpropanamide
CID 54895428
N-(3,4-dimethoxyphenyl)-2-(3-methylphenyl)acetamide
CID 9497409
2-[4-(aminomethyl)phenyl]-N-(3-methylphenyl)acetamide
CID 63590654

Frequently Asked Questions

What is the IUPAC name of N-[3-(methylaminomethyl)phenyl]-2-(3-methylphenyl)acetamide?
The IUPAC name of N-[3-(methylaminomethyl)phenyl]-2-(3-methylphenyl)acetamide (CID 62388896) is N-[3-(methylaminomethyl)phenyl]-2-(3-methylphenyl)acetamide.
What is the SMILES notation for N-[3-(methylaminomethyl)phenyl]-2-(3-methylphenyl)acetamide?
The canonical SMILES for N-[3-(methylaminomethyl)phenyl]-2-(3-methylphenyl)acetamide is CNCc1cccc(NC(=O)Cc2cccc(C)c2)c1.
What is the InChIKey of N-[3-(methylaminomethyl)phenyl]-2-(3-methylphenyl)acetamide?
The InChIKey is PIQILTSPHFSOHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O/c1-13-5-3-6-14(9-13)11-17(20)19-16-8-4-7-15(10-16)12-18-2/h3-10,18H,11-12H2,1-2H3,(H,19,20).
What are the key properties of N-[3-(methylaminomethyl)phenyl]-2-(3-methylphenyl)acetamide?
N-[3-(methylaminomethyl)phenyl]-2-(3-methylphenyl)acetamide has a molecular weight of 268.36 g/mol, XLogP of 2.90, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(methylaminomethyl)phenyl]-2-(3-methylphenyl)acetamide is sourced from PubChem (CID 62388896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).