N-[3-chloro-5-(trifluoromethyl)phenyl]-3-hydroxypyridine-4-carboxamide

C13H8ClF3N2O2 — CID 116700273

IUPACN-[3-chloro-5-(trifluoromethyl)phenyl]-3-hydroxypyridine-4-carboxamide
SMILESO=C(Nc1cc(Cl)cc(C(F)(F)F)c1)c1ccncc1O
InChIInChI=1S/C13H8ClF3N2O2/c14-8-3-7(13(15,16)17)4-9(5-8)19-12(21)10-1-2-18-6-11(10)20/h1-6,20H,(H,19,21)
InChIKeyUBWIQEQHYOUKFC-UHFFFAOYSA-N
MW316.67 g/mol
LogP3.71
Rot. Bonds2

About N-[3-chloro-5-(trifluoromethyl)phenyl]-3-hydroxypyridine-4-carboxamide

N-[3-chloro-5-(trifluoromethyl)phenyl]-3-hydroxypyridine-4-carboxamide (PubChem CID 116700273) has the molecular formula C13H8ClF3N2O2 and a molecular weight of 316.67 g/mol. Its IUPAC name is N-[3-chloro-5-(trifluoromethyl)phenyl]-3-hydroxypyridine-4-carboxamide.

Molecular Properties

Compound NameN-[3-chloro-5-(trifluoromethyl)phenyl]-3-hydroxypyridine-4-carboxamide
PubChem CID116700273
Molecular FormulaC13H8ClF3N2O2
Molecular Weight316.67 g/mol
Exact Mass316.02
IUPAC NameN-[3-chloro-5-(trifluoromethyl)phenyl]-3-hydroxypyridine-4-carboxamide
SMILESO=C(Nc1cc(Cl)cc(C(F)(F)F)c1)c1ccncc1O
InChIInChI=1S/C13H8ClF3N2O2/c14-8-3-7(13(15,16)17)4-9(5-8)19-12(21)10-1-2-18-6-11(10)20/h1-6,20H,(H,19,21)
InChIKeyUBWIQEQHYOUKFC-UHFFFAOYSA-N
XLogP3.71
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.67
LogP ≤ 53.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-chlorophenyl)-3-hydroxypyridine-4-carboxamide
CID 81443324
N-(3,4-dichlorophenyl)-3-hydroxypyridine-4-carboxamide
CID 81442671
N-(3,5-dichlorophenyl)-3-fluoropyridine-4-carboxamide
CID 115645307
N-(3,4-difluorophenyl)-3-hydroxypyridine-4-carboxamide
CID 81442995
2-[[3-chloro-5-(trifluoromethyl)phenyl]carbamoyl]benzoic acid
CID 85472840
5-bromo-N-[3-chloro-5-(trifluoromethyl)phenyl]pyridine-2-carboxamide
CID 116700198
2-fluoro-5-[(3-hydroxypyridine-4-carbonyl)amino]benzoic acid
CID 81445446
N-(3-chloro-5-methylphenyl)-2-hydroxy-4-(trifluoromethyl)benzamide
CID 167685587
N-[3-chloro-5-(trifluoromethyl)phenyl]-4-sulfanylbenzamide
CID 107036187
3-chloro-N-[2-chloro-5-(trifluoromethyl)phenyl]pyridine-4-carboxamide
CID 66464004
N-(2-chlorophenyl)-3-hydroxypyridine-4-carboxamide
CID 81443413
N-[3-bromo-5-(trifluoromethyl)phenyl]-5-chloro-2-hydroxybenzamide
CID 71381238

Frequently Asked Questions

What is the IUPAC name of N-[3-chloro-5-(trifluoromethyl)phenyl]-3-hydroxypyridine-4-carboxamide?
The IUPAC name of N-[3-chloro-5-(trifluoromethyl)phenyl]-3-hydroxypyridine-4-carboxamide (CID 116700273) is N-[3-chloro-5-(trifluoromethyl)phenyl]-3-hydroxypyridine-4-carboxamide.
What is the SMILES notation for N-[3-chloro-5-(trifluoromethyl)phenyl]-3-hydroxypyridine-4-carboxamide?
The canonical SMILES for N-[3-chloro-5-(trifluoromethyl)phenyl]-3-hydroxypyridine-4-carboxamide is O=C(Nc1cc(Cl)cc(C(F)(F)F)c1)c1ccncc1O.
What is the InChIKey of N-[3-chloro-5-(trifluoromethyl)phenyl]-3-hydroxypyridine-4-carboxamide?
The InChIKey is UBWIQEQHYOUKFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8ClF3N2O2/c14-8-3-7(13(15,16)17)4-9(5-8)19-12(21)10-1-2-18-6-11(10)20/h1-6,20H,(H,19,21).
What are the key properties of N-[3-chloro-5-(trifluoromethyl)phenyl]-3-hydroxypyridine-4-carboxamide?
N-[3-chloro-5-(trifluoromethyl)phenyl]-3-hydroxypyridine-4-carboxamide has a molecular weight of 316.67 g/mol, XLogP of 3.71, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-chloro-5-(trifluoromethyl)phenyl]-3-hydroxypyridine-4-carboxamide is sourced from PubChem (CID 116700273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).