N-benzyl-3-(dimethylamino)benzamide

C16H18N2O — CID 2567270

IUPACN-benzyl-3-(dimethylamino)benzamide
SMILESCN(C)c1cccc(C(=O)NCc2ccccc2)c1
InChIInChI=1S/C16H18N2O/c1-18(2)15-10-6-9-14(11-15)16(19)17-12-13-7-4-3-5-8-13/h3-11H,12H2,1-2H3,(H,17,19)
InChIKeyZVOIQGIKHDKGAK-UHFFFAOYSA-N
MW254.33 g/mol
LogP2.68
Rot. Bonds4

About N-benzyl-3-(dimethylamino)benzamide

N-benzyl-3-(dimethylamino)benzamide (PubChem CID 2567270) has the molecular formula C16H18N2O and a molecular weight of 254.33 g/mol. Its IUPAC name is N-benzyl-3-(dimethylamino)benzamide.

Molecular Properties

Compound NameN-benzyl-3-(dimethylamino)benzamide
PubChem CID2567270
Molecular FormulaC16H18N2O
Molecular Weight254.33 g/mol
Exact Mass254.14
IUPAC NameN-benzyl-3-(dimethylamino)benzamide
SMILESCN(C)c1cccc(C(=O)NCc2ccccc2)c1
InChIInChI=1S/C16H18N2O/c1-18(2)15-10-6-9-14(11-15)16(19)17-12-13-7-4-3-5-8-13/h3-11H,12H2,1-2H3,(H,17,19)
InChIKeyZVOIQGIKHDKGAK-UHFFFAOYSA-N
XLogP2.68
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.33
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-benzyl-3-(dimethylamino)benzamide?
The IUPAC name of N-benzyl-3-(dimethylamino)benzamide (CID 2567270) is N-benzyl-3-(dimethylamino)benzamide.
What is the SMILES notation for N-benzyl-3-(dimethylamino)benzamide?
The canonical SMILES for N-benzyl-3-(dimethylamino)benzamide is CN(C)c1cccc(C(=O)NCc2ccccc2)c1.
What is the InChIKey of N-benzyl-3-(dimethylamino)benzamide?
The InChIKey is ZVOIQGIKHDKGAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O/c1-18(2)15-10-6-9-14(11-15)16(19)17-12-13-7-4-3-5-8-13/h3-11H,12H2,1-2H3,(H,17,19).
What are the key properties of N-benzyl-3-(dimethylamino)benzamide?
N-benzyl-3-(dimethylamino)benzamide has a molecular weight of 254.33 g/mol, XLogP of 2.68, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-3-(dimethylamino)benzamide is sourced from PubChem (CID 2567270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).