N-[4-(aminomethyl)phenyl]-2-(4-methylphenyl)acetamide

C16H18N2O — CID 43152378

IUPACN-[4-(aminomethyl)phenyl]-2-(4-methylphenyl)acetamide
SMILESCc1ccc(CC(=O)Nc2ccc(CN)cc2)cc1
InChIInChI=1S/C16H18N2O/c1-12-2-4-13(5-3-12)10-16(19)18-15-8-6-14(11-17)7-9-15/h2-9H,10-11,17H2,1H3,(H,18,19)
InChIKeyXAYPPBJQUSEEQS-UHFFFAOYSA-N
MW254.33 g/mol
LogP2.63
Rot. Bonds4

About N-[4-(aminomethyl)phenyl]-2-(4-methylphenyl)acetamide

N-[4-(aminomethyl)phenyl]-2-(4-methylphenyl)acetamide (PubChem CID 43152378) has the molecular formula C16H18N2O and a molecular weight of 254.33 g/mol. Its IUPAC name is N-[4-(aminomethyl)phenyl]-2-(4-methylphenyl)acetamide.

Molecular Properties

Compound NameN-[4-(aminomethyl)phenyl]-2-(4-methylphenyl)acetamide
PubChem CID43152378
Molecular FormulaC16H18N2O
Molecular Weight254.33 g/mol
Exact Mass254.14
IUPAC NameN-[4-(aminomethyl)phenyl]-2-(4-methylphenyl)acetamide
SMILESCc1ccc(CC(=O)Nc2ccc(CN)cc2)cc1
InChIInChI=1S/C16H18N2O/c1-12-2-4-13(5-3-12)10-16(19)18-15-8-6-14(11-17)7-9-15/h2-9H,10-11,17H2,1H3,(H,18,19)
InChIKeyXAYPPBJQUSEEQS-UHFFFAOYSA-N
XLogP2.63
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.33
LogP ≤ 52.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N'-[4-(aminomethyl)phenyl]-N-(4-methylphenyl)butanediamide
CID 143641353
N-[4-(2-aminoethyl)phenyl]-2-(4-methylphenyl)acetamide
CID 62301337
N-[4-(2-hydrazinyl-2-oxoethyl)phenyl]-2-(4-methylphenyl)acetamide
CID 155375566
2-(4-aminophenyl)-N-(4-methylphenyl)acetamide
CID 16782162
N-(4-fluorophenyl)-2-(4-methylphenyl)acetamide
CID 889367
2-[4-(aminomethyl)phenyl]-N-(3-methylphenyl)acetamide
CID 63590654
4-[[2-[4-(aminomethyl)phenyl]acetyl]amino]benzamide
CID 63589054
N-[[4-(aminomethyl)phenyl]methyl]-2-(4-methylphenyl)acetamide
CID 60917944
2-(3,4-dimethylphenyl)-N-(4-methylphenyl)acetamide
CID 2664751
2-[4-(aminomethyl)phenyl]-N-(2,4-dimethylphenyl)acetamide
CID 63590839
N-(4-methylphenyl)-2-[4-[(2-methylpropan-2-yl)oxy]phenyl]acetamide
CID 110437429
N-[4-(aminomethyl)phenyl]-2-(3-hydroxyphenyl)acetamide
CID 61399107

Frequently Asked Questions

What is the IUPAC name of N-[4-(aminomethyl)phenyl]-2-(4-methylphenyl)acetamide?
The IUPAC name of N-[4-(aminomethyl)phenyl]-2-(4-methylphenyl)acetamide (CID 43152378) is N-[4-(aminomethyl)phenyl]-2-(4-methylphenyl)acetamide.
What is the SMILES notation for N-[4-(aminomethyl)phenyl]-2-(4-methylphenyl)acetamide?
The canonical SMILES for N-[4-(aminomethyl)phenyl]-2-(4-methylphenyl)acetamide is Cc1ccc(CC(=O)Nc2ccc(CN)cc2)cc1.
What is the InChIKey of N-[4-(aminomethyl)phenyl]-2-(4-methylphenyl)acetamide?
The InChIKey is XAYPPBJQUSEEQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O/c1-12-2-4-13(5-3-12)10-16(19)18-15-8-6-14(11-17)7-9-15/h2-9H,10-11,17H2,1H3,(H,18,19).
What are the key properties of N-[4-(aminomethyl)phenyl]-2-(4-methylphenyl)acetamide?
N-[4-(aminomethyl)phenyl]-2-(4-methylphenyl)acetamide has a molecular weight of 254.33 g/mol, XLogP of 2.63, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(aminomethyl)phenyl]-2-(4-methylphenyl)acetamide is sourced from PubChem (CID 43152378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).