1-(3-fluoropyrazin-2-yl)azetidine-3-carboxamide

C8H9FN4O — CID 164648202

IUPAC1-(3-fluoropyrazin-2-yl)azetidine-3-carboxamide
SMILESNC(=O)C1CN(c2nccnc2F)C1
InChIInChI=1S/C8H9FN4O/c9-6-8(12-2-1-11-6)13-3-5(4-13)7(10)14/h1-2,5H,3-4H2,(H2,10,14)
InChIKeyXYWGTKMDGBGNQR-UHFFFAOYSA-N
MW196.19 g/mol
LogP-0.46
Rot. Bonds2

About 1-(3-fluoropyrazin-2-yl)azetidine-3-carboxamide

1-(3-fluoropyrazin-2-yl)azetidine-3-carboxamide (PubChem CID 164648202) has the molecular formula C8H9FN4O and a molecular weight of 196.19 g/mol. Its IUPAC name is 1-(3-fluoropyrazin-2-yl)azetidine-3-carboxamide.

Molecular Properties

Compound Name1-(3-fluoropyrazin-2-yl)azetidine-3-carboxamide
PubChem CID164648202
Molecular FormulaC8H9FN4O
Molecular Weight196.19 g/mol
Exact Mass196.08
IUPAC Name1-(3-fluoropyrazin-2-yl)azetidine-3-carboxamide
SMILESNC(=O)C1CN(c2nccnc2F)C1
InChIInChI=1S/C8H9FN4O/c9-6-8(12-2-1-11-6)13-3-5(4-13)7(10)14/h1-2,5H,3-4H2,(H2,10,14)
InChIKeyXYWGTKMDGBGNQR-UHFFFAOYSA-N
XLogP-0.46
TPSA72.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.19
LogP ≤ 5-0.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[3-(trifluoromethyl)-2-pyridinyl]piperidine-3-carboxamide
CID 47174336
(3S,4S)-1-(3-fluoro-2-pyridinyl)-4-(trifluoromethyl)pyrrolidine-3-carboxamide
CID 120923487
1-(3-bromo-4-methyl-2-pyridinyl)pyrrolidine-3-carboxamide
CID 107257846
1-(3-hydroxy-2-pyridinyl)azetidine-3-carboxylic acid
CID 71649635
1-pyrazolo[1,5-a]pyrazin-4-ylpiperidine-3-carboxamide
CID 172899821
2,2,2-trifluoro-1-[3-[1-(3-fluoropyrazin-2-yl)piperidin-2-yl]piperidin-1-yl]ethanone
CID 126822338
(3S)-1-(5-fluoroquinazolin-4-yl)piperidine-3-carboxamide
CID 94519630
2-[1-(3-carbamoylpyrazin-2-yl)azetidin-3-yl]acetic acid
CID 64616457
(3S)-1-N-(2-piperidin-1-yl-3-pyridinyl)pyrrolidine-1,3-dicarboxamide
CID 95580121
1-(5-fluoro-2-hydrazinylpyrimidin-4-yl)piperidine-3-carboxamide
CID 80918438
1-thieno[3,2-c]pyridin-4-ylpiperidine-3-carboxamide
CID 172899862
1-(5-methyl-3-pyridinyl)azetidine-3-carboxamide
CID 140621426

Frequently Asked Questions

What is the IUPAC name of 1-(3-fluoropyrazin-2-yl)azetidine-3-carboxamide?
The IUPAC name of 1-(3-fluoropyrazin-2-yl)azetidine-3-carboxamide (CID 164648202) is 1-(3-fluoropyrazin-2-yl)azetidine-3-carboxamide.
What is the SMILES notation for 1-(3-fluoropyrazin-2-yl)azetidine-3-carboxamide?
The canonical SMILES for 1-(3-fluoropyrazin-2-yl)azetidine-3-carboxamide is NC(=O)C1CN(c2nccnc2F)C1.
What is the InChIKey of 1-(3-fluoropyrazin-2-yl)azetidine-3-carboxamide?
The InChIKey is XYWGTKMDGBGNQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9FN4O/c9-6-8(12-2-1-11-6)13-3-5(4-13)7(10)14/h1-2,5H,3-4H2,(H2,10,14).
What are the key properties of 1-(3-fluoropyrazin-2-yl)azetidine-3-carboxamide?
1-(3-fluoropyrazin-2-yl)azetidine-3-carboxamide has a molecular weight of 196.19 g/mol, XLogP of -0.46, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-fluoropyrazin-2-yl)azetidine-3-carboxamide is sourced from PubChem (CID 164648202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).