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

C16H15F3N2O2 — CID 38205833

IUPAC3-(dimethylamino)-N-[3-(trifluoromethoxy)phenyl]benzamide
SMILESCN(C)c1cccc(C(=O)Nc2cccc(OC(F)(F)F)c2)c1
InChIInChI=1S/C16H15F3N2O2/c1-21(2)13-7-3-5-11(9-13)15(22)20-12-6-4-8-14(10-12)23-16(17,18)19/h3-10H,1-2H3,(H,20,22)
InChIKeyBYIQEEFHHZUKPE-UHFFFAOYSA-N
MW324.30 g/mol
LogP3.90
Rot. Bonds4

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

3-(dimethylamino)-N-[3-(trifluoromethoxy)phenyl]benzamide (PubChem CID 38205833) has the molecular formula C16H15F3N2O2 and a molecular weight of 324.30 g/mol. Its IUPAC name is 3-(dimethylamino)-N-[3-(trifluoromethoxy)phenyl]benzamide.

Molecular Properties

Compound Name3-(dimethylamino)-N-[3-(trifluoromethoxy)phenyl]benzamide
PubChem CID38205833
Molecular FormulaC16H15F3N2O2
Molecular Weight324.30 g/mol
Exact Mass324.11
IUPAC Name3-(dimethylamino)-N-[3-(trifluoromethoxy)phenyl]benzamide
SMILESCN(C)c1cccc(C(=O)Nc2cccc(OC(F)(F)F)c2)c1
InChIInChI=1S/C16H15F3N2O2/c1-21(2)13-7-3-5-11(9-13)15(22)20-12-6-4-8-14(10-12)23-16(17,18)19/h3-10H,1-2H3,(H,20,22)
InChIKeyBYIQEEFHHZUKPE-UHFFFAOYSA-N
XLogP3.90
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.30
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(dimethylamino)-N-[3-(trifluoromethyl)phenyl]benzamide
CID 2319650
3-(methanesulfonamido)-N-[3-(trifluoromethoxy)phenyl]benzamide
CID 25342351
N-(3-acetylphenyl)-3-(dimethylamino)benzamide
CID 7922589
N-(3-chlorophenyl)-3-(dimethylamino)benzamide
CID 690525
3-methoxy-4-methyl-N-[3-(trifluoromethoxy)phenyl]benzamide
CID 38033064
N-[3-[[3-(dimethylamino)benzoyl]amino]phenyl]pyridine-4-carboxamide
CID 55610611
N-[4-bromo-3-(trifluoromethyl)phenyl]-3-(dimethylamino)benzamide
CID 7920385
2,2-dimethyl-N-[3-(trifluoromethoxy)phenyl]propanamide
CID 60725225
3-(dimethylamino)-N-[3-(hydroxymethyl)phenyl]benzamide
CID 60629966
3-(dimethylamino)-N-pyridin-3-ylbenzamide
CID 23793187
2,2,2-trifluoro-N-[3-(trifluoromethoxy)phenyl]acetamide
CID 62489908
4-(aminomethyl)-N-[3-(trifluoromethoxy)phenyl]benzamide;hydrochloride
CID 171320799

Frequently Asked Questions

What is the IUPAC name of 3-(dimethylamino)-N-[3-(trifluoromethoxy)phenyl]benzamide?
The IUPAC name of 3-(dimethylamino)-N-[3-(trifluoromethoxy)phenyl]benzamide (CID 38205833) is 3-(dimethylamino)-N-[3-(trifluoromethoxy)phenyl]benzamide.
What is the SMILES notation for 3-(dimethylamino)-N-[3-(trifluoromethoxy)phenyl]benzamide?
The canonical SMILES for 3-(dimethylamino)-N-[3-(trifluoromethoxy)phenyl]benzamide is CN(C)c1cccc(C(=O)Nc2cccc(OC(F)(F)F)c2)c1.
What is the InChIKey of 3-(dimethylamino)-N-[3-(trifluoromethoxy)phenyl]benzamide?
The InChIKey is BYIQEEFHHZUKPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15F3N2O2/c1-21(2)13-7-3-5-11(9-13)15(22)20-12-6-4-8-14(10-12)23-16(17,18)19/h3-10H,1-2H3,(H,20,22).
What are the key properties of 3-(dimethylamino)-N-[3-(trifluoromethoxy)phenyl]benzamide?
3-(dimethylamino)-N-[3-(trifluoromethoxy)phenyl]benzamide has a molecular weight of 324.30 g/mol, XLogP of 3.90, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(dimethylamino)-N-[3-(trifluoromethoxy)phenyl]benzamide is sourced from PubChem (CID 38205833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).