N-[3-(trifluoromethoxy)phenyl]pyridine-2-carboxamide

C13H9F3N2O2 — CID 38032499

IUPACN-[3-(trifluoromethoxy)phenyl]pyridine-2-carboxamide
SMILESO=C(Nc1cccc(OC(F)(F)F)c1)c1ccccn1
InChIInChI=1S/C13H9F3N2O2/c14-13(15,16)20-10-5-3-4-9(8-10)18-12(19)11-6-1-2-7-17-11/h1-8H,(H,18,19)
InChIKeyHKZVOVXCSIZDAJ-UHFFFAOYSA-N
MW282.22 g/mol
LogP3.23
Rot. Bonds3

About N-[3-(trifluoromethoxy)phenyl]pyridine-2-carboxamide

N-[3-(trifluoromethoxy)phenyl]pyridine-2-carboxamide (PubChem CID 38032499) has the molecular formula C13H9F3N2O2 and a molecular weight of 282.22 g/mol. Its IUPAC name is N-[3-(trifluoromethoxy)phenyl]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[3-(trifluoromethoxy)phenyl]pyridine-2-carboxamide
PubChem CID38032499
Molecular FormulaC13H9F3N2O2
Molecular Weight282.22 g/mol
Exact Mass282.06
IUPAC NameN-[3-(trifluoromethoxy)phenyl]pyridine-2-carboxamide
SMILESO=C(Nc1cccc(OC(F)(F)F)c1)c1ccccn1
InChIInChI=1S/C13H9F3N2O2/c14-13(15,16)20-10-5-3-4-9(8-10)18-12(19)11-6-1-2-7-17-11/h1-8H,(H,18,19)
InChIKeyHKZVOVXCSIZDAJ-UHFFFAOYSA-N
XLogP3.23
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.22
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

VU0361737
CID 44191096
4-Methoxypicolinamide
CID 5214209
N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]pyridine-2-carboxamide
CID 45560410
N-(3-methoxyphenyl)pyridazine-3-carboxamide
CID 5297391
N-(3-(difluoromethoxy)phenyl)picolinamide
CID 44189740
N-(3,4-dimethoxyphenyl)pyridine-2-carboxamide
CID 2447227
N-(4-fluoro-3-methoxyphenyl)picolinamide
CID 42644786
N-(3-methoxy-4-methylphenyl)picolinamide
CID 44191178
N-methyl-4-[4-[[4-(trifluoromethoxy)phenyl]carbamoylamino]phenoxy]pyridine-2-carboxamide
CID 71682500
N-(benzo[d][1,3]dioxol-5-yl)picolinamide
CID 738280
Pyrazine-2-carboxylic acid (4-trifluoromethoxy-phenyl)-amide
CID 1448426
N-(3-methoxyphenyl)nicotinamide
CID 668900

Frequently Asked Questions

What is the IUPAC name of N-[3-(trifluoromethoxy)phenyl]pyridine-2-carboxamide?
The IUPAC name of N-[3-(trifluoromethoxy)phenyl]pyridine-2-carboxamide (CID 38032499) is N-[3-(trifluoromethoxy)phenyl]pyridine-2-carboxamide.
What is the SMILES notation for N-[3-(trifluoromethoxy)phenyl]pyridine-2-carboxamide?
The canonical SMILES for N-[3-(trifluoromethoxy)phenyl]pyridine-2-carboxamide is O=C(Nc1cccc(OC(F)(F)F)c1)c1ccccn1.
What is the InChIKey of N-[3-(trifluoromethoxy)phenyl]pyridine-2-carboxamide?
The InChIKey is HKZVOVXCSIZDAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9F3N2O2/c14-13(15,16)20-10-5-3-4-9(8-10)18-12(19)11-6-1-2-7-17-11/h1-8H,(H,18,19).
What are the key properties of N-[3-(trifluoromethoxy)phenyl]pyridine-2-carboxamide?
N-[3-(trifluoromethoxy)phenyl]pyridine-2-carboxamide has a molecular weight of 282.22 g/mol, XLogP of 3.23, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(trifluoromethoxy)phenyl]pyridine-2-carboxamide is sourced from PubChem (CID 38032499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).