2-[acetyl(benzyl)amino]-N-[(2-methylphenyl)methyl]acetamide

C19H22N2O2 — CID 113161182

IUPAC2-[acetyl(benzyl)amino]-N-[(2-methylphenyl)methyl]acetamide
SMILESCC(=O)N(CC(=O)NCc1ccccc1C)Cc1ccccc1
InChIInChI=1S/C19H22N2O2/c1-15-8-6-7-11-18(15)12-20-19(23)14-21(16(2)22)13-17-9-4-3-5-10-17/h3-11H,12-14H2,1-2H3,(H,20,23)
InChIKeyBACDFKDSXAKMHW-UHFFFAOYSA-N
MW310.40 g/mol
LogP2.66
Rot. Bonds6

About 2-[acetyl(benzyl)amino]-N-[(2-methylphenyl)methyl]acetamide

2-[acetyl(benzyl)amino]-N-[(2-methylphenyl)methyl]acetamide (PubChem CID 113161182) has the molecular formula C19H22N2O2 and a molecular weight of 310.40 g/mol. Its IUPAC name is 2-[acetyl(benzyl)amino]-N-[(2-methylphenyl)methyl]acetamide.

Molecular Properties

Compound Name2-[acetyl(benzyl)amino]-N-[(2-methylphenyl)methyl]acetamide
PubChem CID113161182
Molecular FormulaC19H22N2O2
Molecular Weight310.40 g/mol
Exact Mass310.17
IUPAC Name2-[acetyl(benzyl)amino]-N-[(2-methylphenyl)methyl]acetamide
SMILESCC(=O)N(CC(=O)NCc1ccccc1C)Cc1ccccc1
InChIInChI=1S/C19H22N2O2/c1-15-8-6-7-11-18(15)12-20-19(23)14-21(16(2)22)13-17-9-4-3-5-10-17/h3-11H,12-14H2,1-2H3,(H,20,23)
InChIKeyBACDFKDSXAKMHW-UHFFFAOYSA-N
XLogP2.66
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.40
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[acetyl-[2-(dimethylamino)ethyl]amino]-N-[(2-methylphenyl)methyl]acetamide
CID 113160407
3-[acetyl-[(4-fluorophenyl)methyl]amino]-N-[(2-methylphenyl)methyl]propanamide
CID 113119260
2-[acetyl-[(4-methoxyphenyl)methyl]amino]-N-benzylacetamide
CID 113163044
2-[acetyl-[(4-methylphenyl)methyl]amino]-N-[(4-methylphenyl)methyl]acetamide
CID 113161771
2-[acetyl(benzyl)amino]-N-(1,3-benzodioxol-5-ylmethyl)acetamide
CID 113161193
2-[(4-bromophenyl)methyl-methylamino]-N-[(2-methylphenyl)methyl]acetamide
CID 8539857
2-[acetyl-[(2-methylphenyl)methyl]amino]-N-benzyl-N-phenylacetamide
CID 113161511
2-[methyl-[2-[(2-methylphenyl)methylamino]-2-oxoethyl]amino]propanoic acid;hydrochloride
CID 119913207
2-(N,4-diacetylanilino)-N-[(2-methylphenyl)methyl]acetamide
CID 113175570
2-[acetyl-[(4-methylphenyl)methyl]amino]-N-(pyridin-3-ylmethyl)acetamide
CID 113161783
N-ethyl-2-[ethyl-[2-[(2-methylphenyl)methylamino]-2-oxoethyl]amino]acetamide
CID 40700700
2-[acetyl-[(4-fluorophenyl)methyl]amino]-N-[(4-methylphenyl)methyl]acetamide
CID 113162350

Frequently Asked Questions

What is the IUPAC name of 2-[acetyl(benzyl)amino]-N-[(2-methylphenyl)methyl]acetamide?
The IUPAC name of 2-[acetyl(benzyl)amino]-N-[(2-methylphenyl)methyl]acetamide (CID 113161182) is 2-[acetyl(benzyl)amino]-N-[(2-methylphenyl)methyl]acetamide.
What is the SMILES notation for 2-[acetyl(benzyl)amino]-N-[(2-methylphenyl)methyl]acetamide?
The canonical SMILES for 2-[acetyl(benzyl)amino]-N-[(2-methylphenyl)methyl]acetamide is CC(=O)N(CC(=O)NCc1ccccc1C)Cc1ccccc1.
What is the InChIKey of 2-[acetyl(benzyl)amino]-N-[(2-methylphenyl)methyl]acetamide?
The InChIKey is BACDFKDSXAKMHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O2/c1-15-8-6-7-11-18(15)12-20-19(23)14-21(16(2)22)13-17-9-4-3-5-10-17/h3-11H,12-14H2,1-2H3,(H,20,23).
What are the key properties of 2-[acetyl(benzyl)amino]-N-[(2-methylphenyl)methyl]acetamide?
2-[acetyl(benzyl)amino]-N-[(2-methylphenyl)methyl]acetamide has a molecular weight of 310.40 g/mol, XLogP of 2.66, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[acetyl(benzyl)amino]-N-[(2-methylphenyl)methyl]acetamide is sourced from PubChem (CID 113161182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).