N-benzyl-N-methyl-2-[(2-naphthalen-2-yloxyacetyl)amino]benzamide

C27H24N2O3 — CID 4937337

IUPACN-benzyl-N-methyl-2-[(2-naphthalen-2-yloxyacetyl)amino]benzamide
SMILESCN(Cc1ccccc1)C(=O)c1ccccc1NC(=O)COc1ccc2ccccc2c1
InChIInChI=1S/C27H24N2O3/c1-29(18-20-9-3-2-4-10-20)27(31)24-13-7-8-14-25(24)28-26(30)19-32-23-16-15-21-11-5-6-12-22(21)17-23/h2-17H,18-19H2,1H3,(H,28,30)
InChIKeyWIVUZLGVDNKTCS-UHFFFAOYSA-N
MW424.50 g/mol
LogP5.13
Rot. Bonds7

About N-benzyl-N-methyl-2-[(2-naphthalen-2-yloxyacetyl)amino]benzamide

N-benzyl-N-methyl-2-[(2-naphthalen-2-yloxyacetyl)amino]benzamide (PubChem CID 4937337) has the molecular formula C27H24N2O3 and a molecular weight of 424.50 g/mol. Its IUPAC name is N-benzyl-N-methyl-2-[(2-naphthalen-2-yloxyacetyl)amino]benzamide.

Molecular Properties

Compound NameN-benzyl-N-methyl-2-[(2-naphthalen-2-yloxyacetyl)amino]benzamide
PubChem CID4937337
Molecular FormulaC27H24N2O3
Molecular Weight424.50 g/mol
Exact Mass424.18
IUPAC NameN-benzyl-N-methyl-2-[(2-naphthalen-2-yloxyacetyl)amino]benzamide
SMILESCN(Cc1ccccc1)C(=O)c1ccccc1NC(=O)COc1ccc2ccccc2c1
InChIInChI=1S/C27H24N2O3/c1-29(18-20-9-3-2-4-10-20)27(31)24-13-7-8-14-25(24)28-26(30)19-32-23-16-15-21-11-5-6-12-22(21)17-23/h2-17H,18-19H2,1H3,(H,28,30)
InChIKeyWIVUZLGVDNKTCS-UHFFFAOYSA-N
XLogP5.13
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500424.50
LogP ≤ 55.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-benzyl-2-[(2-methoxyacetyl)amino]-N-methylbenzamide
CID 17311924
N-benzyl-2-[[2-(2,4-dichlorophenoxy)acetyl]amino]-N-methylbenzamide
CID 4937312
N-benzyl-2-[[2-(4-bromo-2-methylphenoxy)acetyl]amino]-N-methylbenzamide
CID 4937395
2-[(2-naphthalen-2-yloxyacetyl)amino]-N-prop-2-enylbenzamide
CID 4932273
N-[2-[benzyl(methyl)carbamoyl]phenyl]naphthalene-1-carboxamide
CID 30337138
N-(2-methylsulfanylphenyl)-2-naphthalen-2-yloxyacetamide
CID 4805358
N-[4-[benzyl(methyl)sulfamoyl]phenyl]-2-naphthalen-2-yloxyacetamide
CID 3417784
N-(2-aminophenyl)-2-naphthalen-2-yloxyacetamide
CID 16792527
N-(4-fluorophenyl)-2-[(2-naphthalen-2-yloxyacetyl)amino]benzamide
CID 1300898
N-[(4-hydroxyphenyl)methyl]-N-methyl-2-naphthalen-2-yloxyacetamide
CID 51114602
2-naphthalen-2-yloxy-N-(4-phenylmethoxyphenyl)acetamide
CID 1352449
2-[[2-(4-bromophenoxy)acetyl]amino]-N,N-dimethylbenzamide
CID 4942499

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-methyl-2-[(2-naphthalen-2-yloxyacetyl)amino]benzamide?
The IUPAC name of N-benzyl-N-methyl-2-[(2-naphthalen-2-yloxyacetyl)amino]benzamide (CID 4937337) is N-benzyl-N-methyl-2-[(2-naphthalen-2-yloxyacetyl)amino]benzamide.
What is the SMILES notation for N-benzyl-N-methyl-2-[(2-naphthalen-2-yloxyacetyl)amino]benzamide?
The canonical SMILES for N-benzyl-N-methyl-2-[(2-naphthalen-2-yloxyacetyl)amino]benzamide is CN(Cc1ccccc1)C(=O)c1ccccc1NC(=O)COc1ccc2ccccc2c1.
What is the InChIKey of N-benzyl-N-methyl-2-[(2-naphthalen-2-yloxyacetyl)amino]benzamide?
The InChIKey is WIVUZLGVDNKTCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H24N2O3/c1-29(18-20-9-3-2-4-10-20)27(31)24-13-7-8-14-25(24)28-26(30)19-32-23-16-15-21-11-5-6-12-22(21)17-23/h2-17H,18-19H2,1H3,(H,28,30).
What are the key properties of N-benzyl-N-methyl-2-[(2-naphthalen-2-yloxyacetyl)amino]benzamide?
N-benzyl-N-methyl-2-[(2-naphthalen-2-yloxyacetyl)amino]benzamide has a molecular weight of 424.50 g/mol, XLogP of 5.13, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-methyl-2-[(2-naphthalen-2-yloxyacetyl)amino]benzamide is sourced from PubChem (CID 4937337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).