4-(dimethylamino)-N-[(2-hydroxyphenyl)methyl]benzamide

C16H18N2O2 — CID 110473275

IUPAC4-(dimethylamino)-N-[(2-hydroxyphenyl)methyl]benzamide
SMILESCN(C)c1ccc(C(=O)NCc2ccccc2O)cc1
InChIInChI=1S/C16H18N2O2/c1-18(2)14-9-7-12(8-10-14)16(20)17-11-13-5-3-4-6-15(13)19/h3-10,19H,11H2,1-2H3,(H,17,20)
InChIKeyFDXAEULAOHDNPJ-UHFFFAOYSA-N
MW270.33 g/mol
LogP2.39
Rot. Bonds4

About 4-(dimethylamino)-N-[(2-hydroxyphenyl)methyl]benzamide

4-(dimethylamino)-N-[(2-hydroxyphenyl)methyl]benzamide (PubChem CID 110473275) has the molecular formula C16H18N2O2 and a molecular weight of 270.33 g/mol. Its IUPAC name is 4-(dimethylamino)-N-[(2-hydroxyphenyl)methyl]benzamide.

Molecular Properties

Compound Name4-(dimethylamino)-N-[(2-hydroxyphenyl)methyl]benzamide
PubChem CID110473275
Molecular FormulaC16H18N2O2
Molecular Weight270.33 g/mol
Exact Mass270.14
IUPAC Name4-(dimethylamino)-N-[(2-hydroxyphenyl)methyl]benzamide
SMILESCN(C)c1ccc(C(=O)NCc2ccccc2O)cc1
InChIInChI=1S/C16H18N2O2/c1-18(2)14-9-7-12(8-10-14)16(20)17-11-13-5-3-4-6-15(13)19/h3-10,19H,11H2,1-2H3,(H,17,20)
InChIKeyFDXAEULAOHDNPJ-UHFFFAOYSA-N
XLogP2.39
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.33
LogP ≤ 52.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'mannich_A(296)', 'substructure': 'N/A'}

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Related Compounds

4-ethyl-N-[(2-hydroxyphenyl)methyl]benzamide
CID 115598851
N-(2-benzamidoethyl)-4-(dimethylamino)benzamide
CID 38175898
N-[[2-(hydroxymethyl)phenyl]methyl]-4-[methyl(propyl)amino]benzamide
CID 110909622
4-(bromomethyl)-N-[(2-hydroxyphenyl)methyl]benzamide
CID 113241883
4-(dimethylamino)-N-[2-[(2-phenylacetyl)amino]ethyl]benzamide
CID 108540008
4-(dimethylamino)-N-[(4-methylphenyl)methyl]benzamide
CID 669457
4-(dimethylamino)-N-[2-(hydroxymethyl)phenyl]benzamide
CID 60653502
4-(dimethylamino)-N-(3-methyl-2-oxobutyl)benzamide
CID 64997091
4-N-methyl-1-N-[(2-methylphenyl)methyl]-4-N-phenylbenzene-1,4-dicarboxamide
CID 109046812
N-[(2,3-dihydroxyphenyl)methyl]benzamide
CID 143948328
4-(dimethylamino)-N-[[2-(3-methylphenyl)-3-pyridinyl]methyl]benzamide
CID 53148180
4-(dimethylamino)-N-[(2-thiophen-3-yl-3-pyridinyl)methyl]benzamide
CID 121177628

Frequently Asked Questions

What is the IUPAC name of 4-(dimethylamino)-N-[(2-hydroxyphenyl)methyl]benzamide?
The IUPAC name of 4-(dimethylamino)-N-[(2-hydroxyphenyl)methyl]benzamide (CID 110473275) is 4-(dimethylamino)-N-[(2-hydroxyphenyl)methyl]benzamide.
What is the SMILES notation for 4-(dimethylamino)-N-[(2-hydroxyphenyl)methyl]benzamide?
The canonical SMILES for 4-(dimethylamino)-N-[(2-hydroxyphenyl)methyl]benzamide is CN(C)c1ccc(C(=O)NCc2ccccc2O)cc1.
What is the InChIKey of 4-(dimethylamino)-N-[(2-hydroxyphenyl)methyl]benzamide?
The InChIKey is FDXAEULAOHDNPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O2/c1-18(2)14-9-7-12(8-10-14)16(20)17-11-13-5-3-4-6-15(13)19/h3-10,19H,11H2,1-2H3,(H,17,20).
What are the key properties of 4-(dimethylamino)-N-[(2-hydroxyphenyl)methyl]benzamide?
4-(dimethylamino)-N-[(2-hydroxyphenyl)methyl]benzamide has a molecular weight of 270.33 g/mol, XLogP of 2.39, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(dimethylamino)-N-[(2-hydroxyphenyl)methyl]benzamide is sourced from PubChem (CID 110473275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).