2-chloro-6-hydroxy-N-[[4-(trifluoromethyl)phenyl]carbamoyl]benzamide

C15H10ClF3N2O3 — CID 19808580

IUPAC2-chloro-6-hydroxy-N-[[4-(trifluoromethyl)phenyl]carbamoyl]benzamide
SMILESO=C(NC(=O)c1c(O)cccc1Cl)Nc1ccc(C(F)(F)F)cc1
InChIInChI=1S/C15H10ClF3N2O3/c16-10-2-1-3-11(22)12(10)13(23)21-14(24)20-9-6-4-8(5-7-9)15(17,18)19/h1-7,22H,(H2,20,21,23,24)
InChIKeyAIFYOORXONYLBX-UHFFFAOYSA-N
MW358.70 g/mol
LogP4.03
Rot. Bonds2

About 2-chloro-6-hydroxy-N-[[4-(trifluoromethyl)phenyl]carbamoyl]benzamide

2-chloro-6-hydroxy-N-[[4-(trifluoromethyl)phenyl]carbamoyl]benzamide (PubChem CID 19808580) has the molecular formula C15H10ClF3N2O3 and a molecular weight of 358.70 g/mol. Its IUPAC name is 2-chloro-6-hydroxy-N-[[4-(trifluoromethyl)phenyl]carbamoyl]benzamide.

Molecular Properties

Compound Name2-chloro-6-hydroxy-N-[[4-(trifluoromethyl)phenyl]carbamoyl]benzamide
PubChem CID19808580
Molecular FormulaC15H10ClF3N2O3
Molecular Weight358.70 g/mol
Exact Mass358.03
IUPAC Name2-chloro-6-hydroxy-N-[[4-(trifluoromethyl)phenyl]carbamoyl]benzamide
SMILESO=C(NC(=O)c1c(O)cccc1Cl)Nc1ccc(C(F)(F)F)cc1
InChIInChI=1S/C15H10ClF3N2O3/c16-10-2-1-3-11(22)12(10)13(23)21-14(24)20-9-6-4-8(5-7-9)15(17,18)19/h1-7,22H,(H2,20,21,23,24)
InChIKeyAIFYOORXONYLBX-UHFFFAOYSA-N
XLogP4.03
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.70
LogP ≤ 54.03
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2,6-difluoro-N-[[4-[4-(trifluoromethyl)phenyl]phenyl]carbamoyl]benzamide
CID 134122808
N-[[6-[3,5-bis(trifluoromethyl)phenyl]sulfanyl-3-pyridinyl]carbamoyl]-2,6-dichlorobenzamide
CID 12912782
2,6-dichloro-N-[[6-[2-fluoro-5-(trifluoromethyl)phenoxy]-3-pyridinyl]carbamoyl]benzamide
CID 57322394
2-chloro-N-[4-(trifluoromethyl)phenyl]benzamide
CID 2064029
2,6-dichloro-N-[[6-[3-(trifluoromethyl)phenoxy]-3-pyridinyl]carbamoyl]benzamide
CID 12912760
2,6-dichloro-N-[[6-[3-(trifluoromethyl)phenyl]sulfanyl-3-pyridinyl]carbamoyl]benzamide
CID 12912749
2,6-dichloro-N-[[3,5-dichloro-4-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]carbamoyl]benzamide
CID 141292043
N-[[4-[carbamoyl-[2-chloro-3,5-bis(trifluoromethyl)phenyl]carbamoyl]phenyl]carbamoyl]-2,6-dichlorobenzamide
CID 142632390
2,6-dichloro-N-[[4-(2,3-dichlorocyclopropyl)phenyl]carbamoyl]benzamide
CID 19006403
3-chloro-N-[4-(trifluoromethyl)phenyl]pyridine-2-carboxamide
CID 118113315
2,6-dichloro-N-[[6-[2-(trifluoromethyl)phenoxy]-3-pyridinyl]carbamoyl]benzamide
CID 12912773
4,5-dichloro-2-hydroxy-N-[4-(trifluoromethyl)phenyl]benzamide
CID 134151897

Frequently Asked Questions

What is the IUPAC name of 2-chloro-6-hydroxy-N-[[4-(trifluoromethyl)phenyl]carbamoyl]benzamide?
The IUPAC name of 2-chloro-6-hydroxy-N-[[4-(trifluoromethyl)phenyl]carbamoyl]benzamide (CID 19808580) is 2-chloro-6-hydroxy-N-[[4-(trifluoromethyl)phenyl]carbamoyl]benzamide.
What is the SMILES notation for 2-chloro-6-hydroxy-N-[[4-(trifluoromethyl)phenyl]carbamoyl]benzamide?
The canonical SMILES for 2-chloro-6-hydroxy-N-[[4-(trifluoromethyl)phenyl]carbamoyl]benzamide is O=C(NC(=O)c1c(O)cccc1Cl)Nc1ccc(C(F)(F)F)cc1.
What is the InChIKey of 2-chloro-6-hydroxy-N-[[4-(trifluoromethyl)phenyl]carbamoyl]benzamide?
The InChIKey is AIFYOORXONYLBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10ClF3N2O3/c16-10-2-1-3-11(22)12(10)13(23)21-14(24)20-9-6-4-8(5-7-9)15(17,18)19/h1-7,22H,(H2,20,21,23,24).
What are the key properties of 2-chloro-6-hydroxy-N-[[4-(trifluoromethyl)phenyl]carbamoyl]benzamide?
2-chloro-6-hydroxy-N-[[4-(trifluoromethyl)phenyl]carbamoyl]benzamide has a molecular weight of 358.70 g/mol, XLogP of 4.03, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-6-hydroxy-N-[[4-(trifluoromethyl)phenyl]carbamoyl]benzamide is sourced from PubChem (CID 19808580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).