5-amino-2-[3-(trifluoromethyl)pyrazol-1-yl]pyridine-4-carboxamide

C10H8F3N5O — CID 114090520

IUPAC5-amino-2-[3-(trifluoromethyl)pyrazol-1-yl]pyridine-4-carboxamide
SMILESNC(=O)c1cc(-n2ccc(C(F)(F)F)n2)ncc1N
InChIInChI=1S/C10H8F3N5O/c11-10(12,13)7-1-2-18(17-7)8-3-5(9(15)19)6(14)4-16-8/h1-4H,14H2,(H2,15,19)
InChIKeyWQAGDNBZHMSFFY-UHFFFAOYSA-N
MW271.20 g/mol
LogP0.97
Rot. Bonds2

About 5-amino-2-[3-(trifluoromethyl)pyrazol-1-yl]pyridine-4-carboxamide

5-amino-2-[3-(trifluoromethyl)pyrazol-1-yl]pyridine-4-carboxamide (PubChem CID 114090520) has the molecular formula C10H8F3N5O and a molecular weight of 271.20 g/mol. Its IUPAC name is 5-amino-2-[3-(trifluoromethyl)pyrazol-1-yl]pyridine-4-carboxamide.

Molecular Properties

Compound Name5-amino-2-[3-(trifluoromethyl)pyrazol-1-yl]pyridine-4-carboxamide
PubChem CID114090520
Molecular FormulaC10H8F3N5O
Molecular Weight271.20 g/mol
Exact Mass271.07
IUPAC Name5-amino-2-[3-(trifluoromethyl)pyrazol-1-yl]pyridine-4-carboxamide
SMILESNC(=O)c1cc(-n2ccc(C(F)(F)F)n2)ncc1N
InChIInChI=1S/C10H8F3N5O/c11-10(12,13)7-1-2-18(17-7)8-3-5(9(15)19)6(14)4-16-8/h1-4H,14H2,(H2,15,19)
InChIKeyWQAGDNBZHMSFFY-UHFFFAOYSA-N
XLogP0.97
TPSA99.82 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.20
LogP ≤ 50.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-fluoro-2-[3-(trifluoromethyl)pyrazol-1-yl]pyridine
CID 177229961
4-(trifluoromethyl)-6-[3-(trifluoromethyl)pyrazol-1-yl]pyrimidin-2-amine
CID 114566082
[6-[3-(trifluoromethyl)pyrazol-1-yl]pyrimidin-4-yl]hydrazine
CID 80900694
4-(3-aminopyrazol-1-yl)-2-(trifluoromethyl)benzamide
CID 61175658
3-(4-piperidin-4-ylanilino)-5-[3-(trifluoromethyl)pyrazol-1-yl]pyrazine-2-carboxamide
CID 146558901
2-cyclopropyl-6-[3-(trifluoromethyl)pyrazol-1-yl]pyrimidin-4-amine
CID 80965712
ethane;5-ethyl-2-[3-(trifluoromethyl)pyrazol-1-yl]pyridine
CID 142831358
3-[3-(trifluoromethyl)pyrazol-1-yl]pyridine-4-carboxylic acid
CID 113269776
4-amino-1-[6-(trifluoromethyl)pyridazin-3-yl]pyrazole-3-carboxamide
CID 107346541
5-chloro-2-[3-(trifluoromethyl)pyrazol-1-yl]benzoic acid
CID 55136857
5-iodo-2-(trifluoromethyl)pyridine-4-carboxamide
CID 130865841
4-amino-N-ethyl-3-[3-(trifluoromethyl)pyrazol-1-yl]benzamide
CID 63358810

Frequently Asked Questions

What is the IUPAC name of 5-amino-2-[3-(trifluoromethyl)pyrazol-1-yl]pyridine-4-carboxamide?
The IUPAC name of 5-amino-2-[3-(trifluoromethyl)pyrazol-1-yl]pyridine-4-carboxamide (CID 114090520) is 5-amino-2-[3-(trifluoromethyl)pyrazol-1-yl]pyridine-4-carboxamide.
What is the SMILES notation for 5-amino-2-[3-(trifluoromethyl)pyrazol-1-yl]pyridine-4-carboxamide?
The canonical SMILES for 5-amino-2-[3-(trifluoromethyl)pyrazol-1-yl]pyridine-4-carboxamide is NC(=O)c1cc(-n2ccc(C(F)(F)F)n2)ncc1N.
What is the InChIKey of 5-amino-2-[3-(trifluoromethyl)pyrazol-1-yl]pyridine-4-carboxamide?
The InChIKey is WQAGDNBZHMSFFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8F3N5O/c11-10(12,13)7-1-2-18(17-7)8-3-5(9(15)19)6(14)4-16-8/h1-4H,14H2,(H2,15,19).
What are the key properties of 5-amino-2-[3-(trifluoromethyl)pyrazol-1-yl]pyridine-4-carboxamide?
5-amino-2-[3-(trifluoromethyl)pyrazol-1-yl]pyridine-4-carboxamide has a molecular weight of 271.20 g/mol, XLogP of 0.97, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-2-[3-(trifluoromethyl)pyrazol-1-yl]pyridine-4-carboxamide is sourced from PubChem (CID 114090520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).