3-(dimethylamino)-N-[3-(hydroxymethyl)phenyl]benzamide

C16H18N2O2 — CID 60629966

IUPAC3-(dimethylamino)-N-[3-(hydroxymethyl)phenyl]benzamide
SMILESCN(C)c1cccc(C(=O)Nc2cccc(CO)c2)c1
InChIInChI=1S/C16H18N2O2/c1-18(2)15-8-4-6-13(10-15)16(20)17-14-7-3-5-12(9-14)11-19/h3-10,19H,11H2,1-2H3,(H,17,20)
InChIKeyVVSAFRZOQFQLDS-UHFFFAOYSA-N
MW270.33 g/mol
LogP2.50
Rot. Bonds4

About 3-(dimethylamino)-N-[3-(hydroxymethyl)phenyl]benzamide

3-(dimethylamino)-N-[3-(hydroxymethyl)phenyl]benzamide (PubChem CID 60629966) has the molecular formula C16H18N2O2 and a molecular weight of 270.33 g/mol. Its IUPAC name is 3-(dimethylamino)-N-[3-(hydroxymethyl)phenyl]benzamide.

Molecular Properties

Compound Name3-(dimethylamino)-N-[3-(hydroxymethyl)phenyl]benzamide
PubChem CID60629966
Molecular FormulaC16H18N2O2
Molecular Weight270.33 g/mol
Exact Mass270.14
IUPAC Name3-(dimethylamino)-N-[3-(hydroxymethyl)phenyl]benzamide
SMILESCN(C)c1cccc(C(=O)Nc2cccc(CO)c2)c1
InChIInChI=1S/C16H18N2O2/c1-18(2)15-8-4-6-13(10-15)16(20)17-14-7-3-5-12(9-14)11-19/h3-10,19H,11H2,1-2H3,(H,17,20)
InChIKeyVVSAFRZOQFQLDS-UHFFFAOYSA-N
XLogP2.50
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 ≤ 52.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-acetylphenyl)-3-(dimethylamino)benzamide
CID 7922589
N-(3-chlorophenyl)-3-(dimethylamino)benzamide
CID 690525
N-[3-[[3-(dimethylamino)benzoyl]amino]phenyl]pyridine-4-carboxamide
CID 55610611
3-(dimethylamino)-N-[3-(trifluoromethyl)phenyl]benzamide
CID 2319650
3-(dimethylamino)-N-(4-methylphenyl)benzamide
CID 7899886
3-(dimethylamino)-N-[[4-(hydroxymethyl)phenyl]methyl]benzamide
CID 107231911
N-[4-(diethylamino)phenyl]-3-(dimethylamino)benzamide
CID 8761945
N-(4-bromophenyl)-3-(dimethylamino)benzamide
CID 690521
N-[3-(hydroxymethyl)phenyl]-4-[methyl(phenyl)sulfamoyl]benzamide
CID 9299545
3-(dimethylamino)-N-pyridin-3-ylbenzamide
CID 23793187
N-[3-(chloromethyl)phenyl]-4-(dimethylamino)benzamide
CID 114293242
3-(dimethylamino)-N-[3-[2-(1-methylbenzimidazol-2-yl)ethyl]phenyl]benzamide
CID 46328410

Frequently Asked Questions

What is the IUPAC name of 3-(dimethylamino)-N-[3-(hydroxymethyl)phenyl]benzamide?
The IUPAC name of 3-(dimethylamino)-N-[3-(hydroxymethyl)phenyl]benzamide (CID 60629966) is 3-(dimethylamino)-N-[3-(hydroxymethyl)phenyl]benzamide.
What is the SMILES notation for 3-(dimethylamino)-N-[3-(hydroxymethyl)phenyl]benzamide?
The canonical SMILES for 3-(dimethylamino)-N-[3-(hydroxymethyl)phenyl]benzamide is CN(C)c1cccc(C(=O)Nc2cccc(CO)c2)c1.
What is the InChIKey of 3-(dimethylamino)-N-[3-(hydroxymethyl)phenyl]benzamide?
The InChIKey is VVSAFRZOQFQLDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O2/c1-18(2)15-8-4-6-13(10-15)16(20)17-14-7-3-5-12(9-14)11-19/h3-10,19H,11H2,1-2H3,(H,17,20).
What are the key properties of 3-(dimethylamino)-N-[3-(hydroxymethyl)phenyl]benzamide?
3-(dimethylamino)-N-[3-(hydroxymethyl)phenyl]benzamide has a molecular weight of 270.33 g/mol, XLogP of 2.50, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(dimethylamino)-N-[3-(hydroxymethyl)phenyl]benzamide is sourced from PubChem (CID 60629966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).