3-amino-N-(1-fluoropyrazol-4-yl)pyrazine-2-carboxamide

C8H7FN6O — CID 155712461

IUPAC3-amino-N-(1-fluoropyrazol-4-yl)pyrazine-2-carboxamide
SMILESNc1nccnc1C(=O)Nc1cnn(F)c1
InChIInChI=1S/C8H7FN6O/c9-15-4-5(3-13-15)14-8(16)6-7(10)12-2-1-11-6/h1-4H,(H2,10,12)(H,14,16)
InChIKeyCINVQTZDYLVBLM-UHFFFAOYSA-N
MW222.18 g/mol
LogP0.24
Rot. Bonds2

About 3-amino-N-(1-fluoropyrazol-4-yl)pyrazine-2-carboxamide

3-amino-N-(1-fluoropyrazol-4-yl)pyrazine-2-carboxamide (PubChem CID 155712461) has the molecular formula C8H7FN6O and a molecular weight of 222.18 g/mol. Its IUPAC name is 3-amino-N-(1-fluoropyrazol-4-yl)pyrazine-2-carboxamide.

Molecular Properties

Compound Name3-amino-N-(1-fluoropyrazol-4-yl)pyrazine-2-carboxamide
PubChem CID155712461
Molecular FormulaC8H7FN6O
Molecular Weight222.18 g/mol
Exact Mass222.07
IUPAC Name3-amino-N-(1-fluoropyrazol-4-yl)pyrazine-2-carboxamide
SMILESNc1nccnc1C(=O)Nc1cnn(F)c1
InChIInChI=1S/C8H7FN6O/c9-15-4-5(3-13-15)14-8(16)6-7(10)12-2-1-11-6/h1-4H,(H2,10,12)(H,14,16)
InChIKeyCINVQTZDYLVBLM-UHFFFAOYSA-N
XLogP0.24
TPSA98.72 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.18
LogP ≤ 50.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

(3-Aminopyrazin-2-yl)-[4-[(1-propan-2-ylpyrazol-4-yl)methyl]-1,4-diazepan-1-yl]methanone
CID 53579241
(3-Aminopyrazin-2-yl)-[2-[(4-methylpyrazol-1-yl)methyl]piperidin-1-yl]methanone
CID 53597803
(3-Aminopyrazin-2-yl)-[2-[(4-methylpyrazol-1-yl)methyl]pyrrolidin-1-yl]methanone
CID 56780197
3-amino-N-(1H-pyrazol-4-yl)pyrazine-2-carboxamide
CID 46412143
5-methyl-N-(1-methylpyrazol-3-yl)pyrazine-2-carboxamide
CID 30541639
3-Amino-5-trifluoromethyl-pyrazine-2-carboxylic acid (2H-pyrazol-3-yl)-amide
CID 71533266
1-[6-(Trifluoromethyl)pyrazin-2-yl]pyrazole-4-carboxamide
CID 123804074
3-[[5-Methyl-1-(2,2,2-trifluoroethyl)pyrazol-4-yl]amino]pyrazine-2-carboxamide
CID 171063544
3-[[3-Methyl-1-(2,2,2-trifluoroethyl)pyrazol-4-yl]amino]pyrazine-2-carboxamide
CID 172503410
3-[[1-[(2R)-2,3-difluoropropyl]-3-methylpyrazol-4-yl]amino]pyrazine-2-carboxamide
CID 172503414
N-[1-(2,2-difluoroethyl)pyrazol-4-yl]-5-methylpyrazine-2-carboxamide
CID 60322749
N-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]pyrazine-2-carboxamide
CID 95741389

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(1-fluoropyrazol-4-yl)pyrazine-2-carboxamide?
The IUPAC name of 3-amino-N-(1-fluoropyrazol-4-yl)pyrazine-2-carboxamide (CID 155712461) is 3-amino-N-(1-fluoropyrazol-4-yl)pyrazine-2-carboxamide.
What is the SMILES notation for 3-amino-N-(1-fluoropyrazol-4-yl)pyrazine-2-carboxamide?
The canonical SMILES for 3-amino-N-(1-fluoropyrazol-4-yl)pyrazine-2-carboxamide is Nc1nccnc1C(=O)Nc1cnn(F)c1.
What is the InChIKey of 3-amino-N-(1-fluoropyrazol-4-yl)pyrazine-2-carboxamide?
The InChIKey is CINVQTZDYLVBLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7FN6O/c9-15-4-5(3-13-15)14-8(16)6-7(10)12-2-1-11-6/h1-4H,(H2,10,12)(H,14,16).
What are the key properties of 3-amino-N-(1-fluoropyrazol-4-yl)pyrazine-2-carboxamide?
3-amino-N-(1-fluoropyrazol-4-yl)pyrazine-2-carboxamide has a molecular weight of 222.18 g/mol, XLogP of 0.24, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(1-fluoropyrazol-4-yl)pyrazine-2-carboxamide is sourced from PubChem (CID 155712461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).