2-[(benzylamino)methyl]benzamide

C15H16N2O — CID 22341819

IUPAC2-[(benzylamino)methyl]benzamide
SMILESNC(=O)c1ccccc1CNCc1ccccc1
InChIInChI=1S/C15H16N2O/c16-15(18)14-9-5-4-8-13(14)11-17-10-12-6-2-1-3-7-12/h1-9,17H,10-11H2,(H2,16,18)
InChIKeySQTLDQORTOFZTI-UHFFFAOYSA-N
MW240.31 g/mol
LogP2.08
Rot. Bonds5

About 2-[(benzylamino)methyl]benzamide

2-[(benzylamino)methyl]benzamide (PubChem CID 22341819) has the molecular formula C15H16N2O and a molecular weight of 240.31 g/mol. Its IUPAC name is 2-[(benzylamino)methyl]benzamide.

Molecular Properties

Compound Name2-[(benzylamino)methyl]benzamide
PubChem CID22341819
Molecular FormulaC15H16N2O
Molecular Weight240.31 g/mol
Exact Mass240.13
IUPAC Name2-[(benzylamino)methyl]benzamide
SMILESNC(=O)c1ccccc1CNCc1ccccc1
InChIInChI=1S/C15H16N2O/c16-15(18)14-9-5-4-8-13(14)11-17-10-12-6-2-1-3-7-12/h1-9,17H,10-11H2,(H2,16,18)
InChIKeySQTLDQORTOFZTI-UHFFFAOYSA-N
XLogP2.08
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.31
LogP ≤ 52.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[[(4-ethylphenyl)methylamino]methyl]benzamide
CID 106899663
2-[(6-hydroxyhexylamino)methyl]benzamide
CID 114009117
2-[[(4-fluorophenyl)methylamino]methyl]benzoic acid;hydrochloride
CID 17158189
2-[[(5-bromothiophen-2-yl)methylamino]methyl]benzamide
CID 54900646
2-[(benzylamino)methyl]phenol chloride
CID 53350489
2-[(cyclohexylmethylamino)methyl]benzamide
CID 43371551
ethyl 2-[(2-carbamoylphenyl)methylamino]acetate
CID 60812400
2-(2-anilino-2-oxoethyl)benzamide
CID 173153266
2-[[(2-hydroxyacetyl)amino]methyl]benzamide
CID 173201145
2-[[(2-hydroxy-2-methylbutyl)amino]methyl]benzamide
CID 65106384
2-[(2-phenylethylamino)methyl]benzoic acid
CID 17157313
2-(methanesulfonamidomethyl)benzamide
CID 69038851

Frequently Asked Questions

What is the IUPAC name of 2-[(benzylamino)methyl]benzamide?
The IUPAC name of 2-[(benzylamino)methyl]benzamide (CID 22341819) is 2-[(benzylamino)methyl]benzamide.
What is the SMILES notation for 2-[(benzylamino)methyl]benzamide?
The canonical SMILES for 2-[(benzylamino)methyl]benzamide is NC(=O)c1ccccc1CNCc1ccccc1.
What is the InChIKey of 2-[(benzylamino)methyl]benzamide?
The InChIKey is SQTLDQORTOFZTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O/c16-15(18)14-9-5-4-8-13(14)11-17-10-12-6-2-1-3-7-12/h1-9,17H,10-11H2,(H2,16,18).
What are the key properties of 2-[(benzylamino)methyl]benzamide?
2-[(benzylamino)methyl]benzamide has a molecular weight of 240.31 g/mol, XLogP of 2.08, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(benzylamino)methyl]benzamide is sourced from PubChem (CID 22341819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).