2-amino-N,5-dimethyl-N-[(2-methylphenyl)methyl]benzamide

C17H20N2O — CID 62073809

IUPAC2-amino-N,5-dimethyl-N-[(2-methylphenyl)methyl]benzamide
SMILESCc1ccc(N)c(C(=O)N(C)Cc2ccccc2C)c1
InChIInChI=1S/C17H20N2O/c1-12-8-9-16(18)15(10-12)17(20)19(3)11-14-7-5-4-6-13(14)2/h4-10H,11,18H2,1-3H3
InChIKeyQYMTVFHADQSAJS-UHFFFAOYSA-N
MW268.36 g/mol
LogP3.16
Rot. Bonds3

About 2-amino-N,5-dimethyl-N-[(2-methylphenyl)methyl]benzamide

2-amino-N,5-dimethyl-N-[(2-methylphenyl)methyl]benzamide (PubChem CID 62073809) has the molecular formula C17H20N2O and a molecular weight of 268.36 g/mol. Its IUPAC name is 2-amino-N,5-dimethyl-N-[(2-methylphenyl)methyl]benzamide.

Molecular Properties

Compound Name2-amino-N,5-dimethyl-N-[(2-methylphenyl)methyl]benzamide
PubChem CID62073809
Molecular FormulaC17H20N2O
Molecular Weight268.36 g/mol
Exact Mass268.16
IUPAC Name2-amino-N,5-dimethyl-N-[(2-methylphenyl)methyl]benzamide
SMILESCc1ccc(N)c(C(=O)N(C)Cc2ccccc2C)c1
InChIInChI=1S/C17H20N2O/c1-12-8-9-16(18)15(10-12)17(20)19(3)11-14-7-5-4-6-13(14)2/h4-10H,11,18H2,1-3H3
InChIKeyQYMTVFHADQSAJS-UHFFFAOYSA-N
XLogP3.16
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N,2,4-trimethyl-N-[(2-methylphenyl)methyl]benzamide
CID 134028537
N-[(2-aminophenyl)methyl]-2-fluoro-N,5-dimethylbenzamide
CID 62516508
2-amino-N-(furan-2-ylmethyl)-N,5-dimethylbenzamide
CID 62072448
N-[(2-aminophenyl)methyl]-2-chloro-N,4-dimethylbenzamide
CID 106860369
3-amino-4-bromo-N-methyl-N-[(2-methylphenyl)methyl]benzamide
CID 61094065
4-amino-N,5-dimethyl-N-[(2-methylphenyl)methyl]thiophene-2-carboxamide
CID 61094456
4-amino-3-methoxy-N-methyl-N-[(2-methylphenyl)methyl]benzamide
CID 104782446
3-amino-N-methyl-N-[(2-methylphenyl)methyl]thiophene-2-carboxamide
CID 61094457
3-amino-2,6-difluoro-N-methyl-N-[(2-methylphenyl)methyl]benzamide
CID 79759533
N-[(2-bromophenyl)methyl]-2-fluoro-N,5-dimethylbenzamide
CID 62515868
2-amino-3-fluoro-N-methyl-N-[(2-methylphenyl)methyl]benzamide
CID 62661751
4-fluoro-2-hydroxy-N-methyl-N-[(2-methylphenyl)methyl]benzamide
CID 103829572

Frequently Asked Questions

What is the IUPAC name of 2-amino-N,5-dimethyl-N-[(2-methylphenyl)methyl]benzamide?
The IUPAC name of 2-amino-N,5-dimethyl-N-[(2-methylphenyl)methyl]benzamide (CID 62073809) is 2-amino-N,5-dimethyl-N-[(2-methylphenyl)methyl]benzamide.
What is the SMILES notation for 2-amino-N,5-dimethyl-N-[(2-methylphenyl)methyl]benzamide?
The canonical SMILES for 2-amino-N,5-dimethyl-N-[(2-methylphenyl)methyl]benzamide is Cc1ccc(N)c(C(=O)N(C)Cc2ccccc2C)c1.
What is the InChIKey of 2-amino-N,5-dimethyl-N-[(2-methylphenyl)methyl]benzamide?
The InChIKey is QYMTVFHADQSAJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O/c1-12-8-9-16(18)15(10-12)17(20)19(3)11-14-7-5-4-6-13(14)2/h4-10H,11,18H2,1-3H3.
What are the key properties of 2-amino-N,5-dimethyl-N-[(2-methylphenyl)methyl]benzamide?
2-amino-N,5-dimethyl-N-[(2-methylphenyl)methyl]benzamide has a molecular weight of 268.36 g/mol, XLogP of 3.16, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N,5-dimethyl-N-[(2-methylphenyl)methyl]benzamide is sourced from PubChem (CID 62073809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).