2-amino-6-methyl-N-[(4-methylphenyl)methyl]benzamide

C16H18N2O — CID 16782894

IUPAC2-amino-6-methyl-N-[(4-methylphenyl)methyl]benzamide
SMILESCc1ccc(CNC(=O)c2c(C)cccc2N)cc1
InChIInChI=1S/C16H18N2O/c1-11-6-8-13(9-7-11)10-18-16(19)15-12(2)4-3-5-14(15)17/h3-9H,10,17H2,1-2H3,(H,18,19)
InChIKeyAIQLKIFTSYBIPZ-UHFFFAOYSA-N
MW254.33 g/mol
LogP2.82
Rot. Bonds3

About 2-amino-6-methyl-N-[(4-methylphenyl)methyl]benzamide

2-amino-6-methyl-N-[(4-methylphenyl)methyl]benzamide (PubChem CID 16782894) has the molecular formula C16H18N2O and a molecular weight of 254.33 g/mol. Its IUPAC name is 2-amino-6-methyl-N-[(4-methylphenyl)methyl]benzamide.

Molecular Properties

Compound Name2-amino-6-methyl-N-[(4-methylphenyl)methyl]benzamide
PubChem CID16782894
Molecular FormulaC16H18N2O
Molecular Weight254.33 g/mol
Exact Mass254.14
IUPAC Name2-amino-6-methyl-N-[(4-methylphenyl)methyl]benzamide
SMILESCc1ccc(CNC(=O)c2c(C)cccc2N)cc1
InChIInChI=1S/C16H18N2O/c1-11-6-8-13(9-7-11)10-18-16(19)15-12(2)4-3-5-14(15)17/h3-9H,10,17H2,1-2H3,(H,18,19)
InChIKeyAIQLKIFTSYBIPZ-UHFFFAOYSA-N
XLogP2.82
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.33
LogP ≤ 52.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

2-amino-N-[[4-(hydroxymethyl)phenyl]methyl]-6-methylbenzamide
CID 107229451
2-amino-N-[(4-bromophenyl)methyl]-6-methylbenzamide
CID 16781523
2-[amino-(2-amino-6-methylbenzoyl)amino]-N-[(4-methylphenyl)methyl]acetamide
CID 138509078
2-amino-N-(furan-2-ylmethyl)-6-methylbenzamide
CID 16782827
2-amino-N-[(3-cyanophenyl)methyl]-6-methylbenzamide
CID 61102170
2-amino-N-[(2-methoxy-4-pyridinyl)methyl]-6-methylbenzamide
CID 62990733
2,6-difluoro-N-[(4-methylphenyl)methyl]benzamide
CID 8781288
2-amino-N-[(4,5-dimethylthiophen-2-yl)methyl]-6-methylbenzamide
CID 65241605
2-amino-6-methylbenzohydrazide;ethane
CID 145125009
2,6-dimethoxy-N-[(4-methylphenyl)methyl]benzamide
CID 743463
4-[[(2,6-dimethylbenzoyl)amino]methyl]benzoic acid
CID 103925447
(4-methylphenyl)methyl 2-amino-6-methylbenzoate
CID 61321736

Frequently Asked Questions

What is the IUPAC name of 2-amino-6-methyl-N-[(4-methylphenyl)methyl]benzamide?
The IUPAC name of 2-amino-6-methyl-N-[(4-methylphenyl)methyl]benzamide (CID 16782894) is 2-amino-6-methyl-N-[(4-methylphenyl)methyl]benzamide.
What is the SMILES notation for 2-amino-6-methyl-N-[(4-methylphenyl)methyl]benzamide?
The canonical SMILES for 2-amino-6-methyl-N-[(4-methylphenyl)methyl]benzamide is Cc1ccc(CNC(=O)c2c(C)cccc2N)cc1.
What is the InChIKey of 2-amino-6-methyl-N-[(4-methylphenyl)methyl]benzamide?
The InChIKey is AIQLKIFTSYBIPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O/c1-11-6-8-13(9-7-11)10-18-16(19)15-12(2)4-3-5-14(15)17/h3-9H,10,17H2,1-2H3,(H,18,19).
What are the key properties of 2-amino-6-methyl-N-[(4-methylphenyl)methyl]benzamide?
2-amino-6-methyl-N-[(4-methylphenyl)methyl]benzamide has a molecular weight of 254.33 g/mol, XLogP of 2.82, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-6-methyl-N-[(4-methylphenyl)methyl]benzamide is sourced from PubChem (CID 16782894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).