2-[4-[(3,4-dimethylphenyl)methylamino]phenyl]acetamide

C17H20N2O — CID 43786878

IUPAC2-[4-[(3,4-dimethylphenyl)methylamino]phenyl]acetamide
SMILESCc1ccc(CNc2ccc(CC(N)=O)cc2)cc1C
InChIInChI=1S/C17H20N2O/c1-12-3-4-15(9-13(12)2)11-19-16-7-5-14(6-8-16)10-17(18)20/h3-9,19H,10-11H2,1-2H3,(H2,18,20)
InChIKeyAPHQIJAPQLDIRR-UHFFFAOYSA-N
MW268.36 g/mol
LogP2.94
Rot. Bonds5

About 2-[4-[(3,4-dimethylphenyl)methylamino]phenyl]acetamide

2-[4-[(3,4-dimethylphenyl)methylamino]phenyl]acetamide (PubChem CID 43786878) has the molecular formula C17H20N2O and a molecular weight of 268.36 g/mol. Its IUPAC name is 2-[4-[(3,4-dimethylphenyl)methylamino]phenyl]acetamide.

Molecular Properties

Compound Name2-[4-[(3,4-dimethylphenyl)methylamino]phenyl]acetamide
PubChem CID43786878
Molecular FormulaC17H20N2O
Molecular Weight268.36 g/mol
Exact Mass268.16
IUPAC Name2-[4-[(3,4-dimethylphenyl)methylamino]phenyl]acetamide
SMILESCc1ccc(CNc2ccc(CC(N)=O)cc2)cc1C
InChIInChI=1S/C17H20N2O/c1-12-3-4-15(9-13(12)2)11-19-16-7-5-14(6-8-16)10-17(18)20/h3-9,19H,10-11H2,1-2H3,(H2,18,20)
InChIKeyAPHQIJAPQLDIRR-UHFFFAOYSA-N
XLogP2.94
TPSA55.12 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 ≤ 52.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[4-[(2,4,5-trimethylphenyl)methylamino]phenyl]acetamide
CID 43786872
2-[4-[(2,4,6-trimethylphenyl)methylamino]phenyl]acetamide
CID 43724074
2-[4-[(4-ethylphenyl)methylamino]phenyl]acetamide
CID 43724073
2-[4-(naphthalen-2-ylmethylamino)phenyl]acetamide
CID 174611975
2-[4-[(3-hydroxyphenyl)methylamino]phenyl]acetamide
CID 43724140
2-[4-[(3,5-dichlorophenyl)methylamino]phenyl]acetamide
CID 60790039
2-[4-[[4-(dimethylamino)phenyl]methylamino]phenyl]acetamide
CID 43724056
4-tert-butyl-N-[(3,4-dimethylphenyl)methyl]aniline
CID 43758536
2-[4-[(3,5-dimethyl-1H-pyrazol-4-yl)methylamino]phenyl]acetamide
CID 43724210
N-[3-[(3,4-dimethylphenyl)methylamino]-4-methylphenyl]acetamide
CID 43789839
2-[4-[(4-nitrophenyl)methylamino]phenyl]acetamide
CID 43724024
N-[(3,4-dimethylphenyl)methyl]-3-fluoro-4-methylaniline
CID 43764440

Frequently Asked Questions

What is the IUPAC name of 2-[4-[(3,4-dimethylphenyl)methylamino]phenyl]acetamide?
The IUPAC name of 2-[4-[(3,4-dimethylphenyl)methylamino]phenyl]acetamide (CID 43786878) is 2-[4-[(3,4-dimethylphenyl)methylamino]phenyl]acetamide.
What is the SMILES notation for 2-[4-[(3,4-dimethylphenyl)methylamino]phenyl]acetamide?
The canonical SMILES for 2-[4-[(3,4-dimethylphenyl)methylamino]phenyl]acetamide is Cc1ccc(CNc2ccc(CC(N)=O)cc2)cc1C.
What is the InChIKey of 2-[4-[(3,4-dimethylphenyl)methylamino]phenyl]acetamide?
The InChIKey is APHQIJAPQLDIRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O/c1-12-3-4-15(9-13(12)2)11-19-16-7-5-14(6-8-16)10-17(18)20/h3-9,19H,10-11H2,1-2H3,(H2,18,20).
What are the key properties of 2-[4-[(3,4-dimethylphenyl)methylamino]phenyl]acetamide?
2-[4-[(3,4-dimethylphenyl)methylamino]phenyl]acetamide has a molecular weight of 268.36 g/mol, XLogP of 2.94, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[(3,4-dimethylphenyl)methylamino]phenyl]acetamide is sourced from PubChem (CID 43786878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).