N-(3-acetylphenyl)-3-(dimethylamino)benzamide

C17H18N2O2 — CID 7922589

IUPACN-(3-acetylphenyl)-3-(dimethylamino)benzamide
SMILESCC(=O)c1cccc(NC(=O)c2cccc(N(C)C)c2)c1
InChIInChI=1S/C17H18N2O2/c1-12(20)13-6-4-8-15(10-13)18-17(21)14-7-5-9-16(11-14)19(2)3/h4-11H,1-3H3,(H,18,21)
InChIKeyLKXPOVRYPDWBTM-UHFFFAOYSA-N
MW282.34 g/mol
LogP3.21
Rot. Bonds4

About N-(3-acetylphenyl)-3-(dimethylamino)benzamide

N-(3-acetylphenyl)-3-(dimethylamino)benzamide (PubChem CID 7922589) has the molecular formula C17H18N2O2 and a molecular weight of 282.34 g/mol. Its IUPAC name is N-(3-acetylphenyl)-3-(dimethylamino)benzamide.

Molecular Properties

Compound NameN-(3-acetylphenyl)-3-(dimethylamino)benzamide
PubChem CID7922589
Molecular FormulaC17H18N2O2
Molecular Weight282.34 g/mol
Exact Mass282.14
IUPAC NameN-(3-acetylphenyl)-3-(dimethylamino)benzamide
SMILESCC(=O)c1cccc(NC(=O)c2cccc(N(C)C)c2)c1
InChIInChI=1S/C17H18N2O2/c1-12(20)13-6-4-8-15(10-13)18-17(21)14-7-5-9-16(11-14)19(2)3/h4-11H,1-3H3,(H,18,21)
InChIKeyLKXPOVRYPDWBTM-UHFFFAOYSA-N
XLogP3.21
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.34
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-chlorophenyl)-3-(dimethylamino)benzamide
CID 690525
N-[3-[[3-(dimethylamino)benzoyl]amino]phenyl]pyridine-4-carboxamide
CID 55610611
3-(dimethylamino)-N-[3-(hydroxymethyl)phenyl]benzamide
CID 60629966
3-(dimethylamino)-N-[3-(trifluoromethyl)phenyl]benzamide
CID 2319650
3-(dimethylamino)-N-(4-methylphenyl)benzamide
CID 7899886
N-(4-bromophenyl)-3-(dimethylamino)benzamide
CID 690521
3-(dimethylamino)-N-pyridin-3-ylbenzamide
CID 23793187
3-(dimethylamino)-N-[3-(trifluoromethoxy)phenyl]benzamide
CID 38205833
3-(dimethylamino)-N-(4-formylphenyl)benzamide
CID 106912114
3-(carbamoylamino)-N-[4-(dimethylamino)phenyl]benzamide
CID 78776448
N-[4-(diethylamino)phenyl]-3-(dimethylamino)benzamide
CID 8761945
4-chloro-N-[3-(dimethylamino)phenyl]benzamide
CID 2310755

Frequently Asked Questions

What is the IUPAC name of N-(3-acetylphenyl)-3-(dimethylamino)benzamide?
The IUPAC name of N-(3-acetylphenyl)-3-(dimethylamino)benzamide (CID 7922589) is N-(3-acetylphenyl)-3-(dimethylamino)benzamide.
What is the SMILES notation for N-(3-acetylphenyl)-3-(dimethylamino)benzamide?
The canonical SMILES for N-(3-acetylphenyl)-3-(dimethylamino)benzamide is CC(=O)c1cccc(NC(=O)c2cccc(N(C)C)c2)c1.
What is the InChIKey of N-(3-acetylphenyl)-3-(dimethylamino)benzamide?
The InChIKey is LKXPOVRYPDWBTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O2/c1-12(20)13-6-4-8-15(10-13)18-17(21)14-7-5-9-16(11-14)19(2)3/h4-11H,1-3H3,(H,18,21).
What are the key properties of N-(3-acetylphenyl)-3-(dimethylamino)benzamide?
N-(3-acetylphenyl)-3-(dimethylamino)benzamide has a molecular weight of 282.34 g/mol, XLogP of 3.21, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetylphenyl)-3-(dimethylamino)benzamide is sourced from PubChem (CID 7922589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).