2-hydroxy-1-N,3-N-bis[4-(trifluoromethyl)phenyl]benzene-1,3-dicarboxamide

C22H14F6N2O3 — CID 155920070

IUPAC2-hydroxy-1-N,3-N-bis[4-(trifluoromethyl)phenyl]benzene-1,3-dicarboxamide
SMILESO=C(Nc1ccc(C(F)(F)F)cc1)c1cccc(C(=O)Nc2ccc(C(F)(F)F)cc2)c1O
InChIInChI=1S/C22H14F6N2O3/c23-21(24,25)12-4-8-14(9-5-12)29-19(32)16-2-1-3-17(18(16)31)20(33)30-15-10-6-13(7-11-15)22(26,27)28/h1-11,31H,(H,29,32)(H,30,33)
InChIKeyAXGWKXBVIACAGE-UHFFFAOYSA-N
MW468.35 g/mol
LogP5.93
Rot. Bonds4

About 2-hydroxy-1-N,3-N-bis[4-(trifluoromethyl)phenyl]benzene-1,3-dicarboxamide

2-hydroxy-1-N,3-N-bis[4-(trifluoromethyl)phenyl]benzene-1,3-dicarboxamide (PubChem CID 155920070) has the molecular formula C22H14F6N2O3 and a molecular weight of 468.35 g/mol. Its IUPAC name is 2-hydroxy-1-N,3-N-bis[4-(trifluoromethyl)phenyl]benzene-1,3-dicarboxamide.

Molecular Properties

Compound Name2-hydroxy-1-N,3-N-bis[4-(trifluoromethyl)phenyl]benzene-1,3-dicarboxamide
PubChem CID155920070
Molecular FormulaC22H14F6N2O3
Molecular Weight468.35 g/mol
Exact Mass468.09
IUPAC Name2-hydroxy-1-N,3-N-bis[4-(trifluoromethyl)phenyl]benzene-1,3-dicarboxamide
SMILESO=C(Nc1ccc(C(F)(F)F)cc1)c1cccc(C(=O)Nc2ccc(C(F)(F)F)cc2)c1O
InChIInChI=1S/C22H14F6N2O3/c23-21(24,25)12-4-8-14(9-5-12)29-19(32)16-2-1-3-17(18(16)31)20(33)30-15-10-6-13(7-11-15)22(26,27)28/h1-11,31H,(H,29,32)(H,30,33)
InChIKeyAXGWKXBVIACAGE-UHFFFAOYSA-N
XLogP5.93
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500468.35
LogP ≤ 55.93
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 2-hydroxy-1-N,3-N-bis[4-(trifluoromethyl)phenyl]benzene-1,3-dicarboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-chloro-N-[4-(trifluoromethyl)phenyl]benzamide
CID 2064029
N-[3,5-bis(trifluoromethyl)phenyl]-2-hydroxy-3-methylbenzamide
CID 57459273
4,5-dichloro-2-hydroxy-N-[4-(trifluoromethyl)phenyl]benzamide
CID 134151897
N-[4-(2-aminoethylamino)phenyl]-2-[4-(trifluoromethyl)phenyl]benzamide
CID 149266248
2-(3-methylanilino)-N-[4-(trifluoromethyl)phenyl]benzamide
CID 21179492
N-[2-oxo-2-[4-(trifluoromethyl)anilino]ethyl]naphthalene-1-carboxamide
CID 1057508
N-[4-(trifluoromethyl)phenyl]-1H-pyrrole-2-carboxamide
CID 9400205
N-(4-hydroxyphenyl)-2-(trifluoromethyl)benzamide
CID 28739363
4-(hydroxymethyl)-N-[4-(trifluoromethyl)phenyl]benzamide
CID 4880235
2-hydroxy-4-(trifluoromethyl)-N-[3-(trifluoromethyl)phenyl]benzamide
CID 154341283
2,5-dimethyl-N-[4-(trifluoromethyl)phenyl]benzamide
CID 7777818
3-oxo-N-[4-(trifluoromethyl)phenyl]-4H-1,4-benzoxazine-5-carboxamide
CID 110699758

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-1-N,3-N-bis[4-(trifluoromethyl)phenyl]benzene-1,3-dicarboxamide?
The IUPAC name of 2-hydroxy-1-N,3-N-bis[4-(trifluoromethyl)phenyl]benzene-1,3-dicarboxamide (CID 155920070) is 2-hydroxy-1-N,3-N-bis[4-(trifluoromethyl)phenyl]benzene-1,3-dicarboxamide.
What is the SMILES notation for 2-hydroxy-1-N,3-N-bis[4-(trifluoromethyl)phenyl]benzene-1,3-dicarboxamide?
The canonical SMILES for 2-hydroxy-1-N,3-N-bis[4-(trifluoromethyl)phenyl]benzene-1,3-dicarboxamide is O=C(Nc1ccc(C(F)(F)F)cc1)c1cccc(C(=O)Nc2ccc(C(F)(F)F)cc2)c1O.
What is the InChIKey of 2-hydroxy-1-N,3-N-bis[4-(trifluoromethyl)phenyl]benzene-1,3-dicarboxamide?
The InChIKey is AXGWKXBVIACAGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H14F6N2O3/c23-21(24,25)12-4-8-14(9-5-12)29-19(32)16-2-1-3-17(18(16)31)20(33)30-15-10-6-13(7-11-15)22(26,27)28/h1-11,31H,(H,29,32)(H,30,33).
What are the key properties of 2-hydroxy-1-N,3-N-bis[4-(trifluoromethyl)phenyl]benzene-1,3-dicarboxamide?
2-hydroxy-1-N,3-N-bis[4-(trifluoromethyl)phenyl]benzene-1,3-dicarboxamide has a molecular weight of 468.35 g/mol, XLogP of 5.93, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-1-N,3-N-bis[4-(trifluoromethyl)phenyl]benzene-1,3-dicarboxamide is sourced from PubChem (CID 155920070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).