2-amino-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide

C13H10F3N3O2 — CID 62060327

IUPAC2-amino-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide
SMILESNc1ncccc1C(=O)Nc1ccc(OC(F)(F)F)cc1
InChIInChI=1S/C13H10F3N3O2/c14-13(15,16)21-9-5-3-8(4-6-9)19-12(20)10-2-1-7-18-11(10)17/h1-7H,(H2,17,18)(H,19,20)
InChIKeySTGMAMKLNFMTJS-UHFFFAOYSA-N
MW297.24 g/mol
LogP2.81
Rot. Bonds3

About 2-amino-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide

2-amino-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide (PubChem CID 62060327) has the molecular formula C13H10F3N3O2 and a molecular weight of 297.24 g/mol. Its IUPAC name is 2-amino-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name2-amino-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide
PubChem CID62060327
Molecular FormulaC13H10F3N3O2
Molecular Weight297.24 g/mol
Exact Mass297.07
IUPAC Name2-amino-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide
SMILESNc1ncccc1C(=O)Nc1ccc(OC(F)(F)F)cc1
InChIInChI=1S/C13H10F3N3O2/c14-13(15,16)21-9-5-3-8(4-6-9)19-12(20)10-2-1-7-18-11(10)17/h1-7H,(H2,17,18)(H,19,20)
InChIKeySTGMAMKLNFMTJS-UHFFFAOYSA-N
XLogP2.81
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.24
LogP ≤ 52.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-fluoroanilino)-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide
CID 23632891
N-(4-fluorophenyl)-2-[4-(trifluoromethoxy)anilino]pyridine-3-carboxamide
CID 23632434
ethyl 2-[3-[[4-(trifluoromethoxy)phenyl]carbamoyl]-2-pyridinyl]acetate
CID 1490625
1-N,2-N,3-N-tris[4-(trifluoromethoxy)phenyl]benzene-1,2,3-tricarboxamide
CID 142144730
2-(cyclohexylamino)-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide
CID 23632911
2-(2-bromoanilino)-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide
CID 23632906
2-(3-fluoroanilino)-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide
CID 23632897
2-(3-methoxyanilino)-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide
CID 23632895
2-amino-N-(3,5-difluorophenyl)pyridine-3-carboxamide
CID 62154038
3-amino-2-(pyridin-4-ylmethyl)-N-[4-(trifluoromethoxy)phenyl]benzamide
CID 174385427
N-[4-(trifluoromethoxy)phenyl]pyridazine-3-carboxamide
CID 23633023
2,3-dimethoxy-N-[4-(trifluoromethoxy)phenyl]benzamide
CID 24641310

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide?
The IUPAC name of 2-amino-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide (CID 62060327) is 2-amino-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide.
What is the SMILES notation for 2-amino-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide?
The canonical SMILES for 2-amino-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide is Nc1ncccc1C(=O)Nc1ccc(OC(F)(F)F)cc1.
What is the InChIKey of 2-amino-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide?
The InChIKey is STGMAMKLNFMTJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10F3N3O2/c14-13(15,16)21-9-5-3-8(4-6-9)19-12(20)10-2-1-7-18-11(10)17/h1-7H,(H2,17,18)(H,19,20).
What are the key properties of 2-amino-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide?
2-amino-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide has a molecular weight of 297.24 g/mol, XLogP of 2.81, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide is sourced from PubChem (CID 62060327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).