3-amino-6-methoxy-5-(trifluoromethyl)pyridine-2-carboxamide

C8H8F3N3O2 — CID 154014203

IUPAC3-amino-6-methoxy-5-(trifluoromethyl)pyridine-2-carboxamide
SMILESCOc1nc(C(N)=O)c(N)cc1C(F)(F)F
InChIInChI=1S/C8H8F3N3O2/c1-16-7-3(8(9,10)11)2-4(12)5(14-7)6(13)15/h2H,12H2,1H3,(H2,13,15)
InChIKeySIEJHBHYDDMANJ-UHFFFAOYSA-N
MW235.16 g/mol
LogP0.79
Rot. Bonds2

About 3-amino-6-methoxy-5-(trifluoromethyl)pyridine-2-carboxamide

3-amino-6-methoxy-5-(trifluoromethyl)pyridine-2-carboxamide (PubChem CID 154014203) has the molecular formula C8H8F3N3O2 and a molecular weight of 235.16 g/mol. Its IUPAC name is 3-amino-6-methoxy-5-(trifluoromethyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name3-amino-6-methoxy-5-(trifluoromethyl)pyridine-2-carboxamide
PubChem CID154014203
Molecular FormulaC8H8F3N3O2
Molecular Weight235.16 g/mol
Exact Mass235.06
IUPAC Name3-amino-6-methoxy-5-(trifluoromethyl)pyridine-2-carboxamide
SMILESCOc1nc(C(N)=O)c(N)cc1C(F)(F)F
InChIInChI=1S/C8H8F3N3O2/c1-16-7-3(8(9,10)11)2-4(12)5(14-7)6(13)15/h2H,12H2,1H3,(H2,13,15)
InChIKeySIEJHBHYDDMANJ-UHFFFAOYSA-N
XLogP0.79
TPSA91.23 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.16
LogP ≤ 50.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-amino-6-methoxy-5-(trifluoromethyl)pyridine-2-carboxylic acid;3-(2,5-dimethylpyrrol-1-yl)-6-methoxy-5-(trifluoromethyl)pyridine-2-carboxylic acid
CID 155389481
5-(1,1-difluoroethyl)-2,6-dimethoxypyridin-3-amine
CID 142578199
3-amino-6-(2-methoxyethoxy)-N-(3,3,3-trifluoro-2-hydroxy-2-methylpropyl)-5-(trifluoromethyl)pyridine-2-carboxamide
CID 78089503
(2S)-2-[5-[3-amino-6-methoxy-5-(trifluoromethyl)-2-pyridinyl]-1,3,4-oxadiazol-2-yl]-1,1,1-trifluoropropan-2-ol
CID 71515757
3-amino-6-pent-4-en-2-yloxy-5-(trifluoromethyl)pyridine-2-carboxylic acid
CID 169126076
3-amino-N-(2-amino-3,3,3-trifluoro-2-methylpropyl)-6-ethoxy-5-(trifluoromethyl)pyridine-2-carboxamide
CID 175748213
2-methoxy-6-methyl-4-(trifluoromethyl)pyridine-3-carboxylic acid
CID 82389554
methyl 5-(difluoromethyl)-6-methoxy-3-(trifluoromethyl)pyridine-2-carboxylate
CID 133099603
3-bromo-6-methoxy-N-(3,3,3-trifluoro-2-hydroxy-2-methylpropyl)-5-(trifluoromethyl)pyridine-2-carboxamide
CID 135153327
3-amino-6-bromo-N-(3,3,3-trifluoro-2-methoxy-2-methylpropyl)-5-(trifluoromethyl)pyridine-2-carboxamide
CID 58442364
ethyl 3-amino-6-(difluoromethyl)-5-(trifluoromethyl)pyridine-2-carboxylate
CID 134684036
6-methoxy-5-(trifluoromethyl)-2-[5-(1,1,1-trifluoro-2-phenylmethoxypropan-2-yl)-1,3,4-oxadiazol-2-yl]pyridin-3-amine;2,2,2-trifluoroacetic acid
CID 86729589

Frequently Asked Questions

What is the IUPAC name of 3-amino-6-methoxy-5-(trifluoromethyl)pyridine-2-carboxamide?
The IUPAC name of 3-amino-6-methoxy-5-(trifluoromethyl)pyridine-2-carboxamide (CID 154014203) is 3-amino-6-methoxy-5-(trifluoromethyl)pyridine-2-carboxamide.
What is the SMILES notation for 3-amino-6-methoxy-5-(trifluoromethyl)pyridine-2-carboxamide?
The canonical SMILES for 3-amino-6-methoxy-5-(trifluoromethyl)pyridine-2-carboxamide is COc1nc(C(N)=O)c(N)cc1C(F)(F)F.
What is the InChIKey of 3-amino-6-methoxy-5-(trifluoromethyl)pyridine-2-carboxamide?
The InChIKey is SIEJHBHYDDMANJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8F3N3O2/c1-16-7-3(8(9,10)11)2-4(12)5(14-7)6(13)15/h2H,12H2,1H3,(H2,13,15).
What are the key properties of 3-amino-6-methoxy-5-(trifluoromethyl)pyridine-2-carboxamide?
3-amino-6-methoxy-5-(trifluoromethyl)pyridine-2-carboxamide has a molecular weight of 235.16 g/mol, XLogP of 0.79, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-6-methoxy-5-(trifluoromethyl)pyridine-2-carboxamide is sourced from PubChem (CID 154014203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).