1-(5-fluoro-2-hydrazinylpyrimidin-4-yl)piperidine-3-carboxamide

C10H15FN6O — CID 80918438

IUPAC1-(5-fluoro-2-hydrazinylpyrimidin-4-yl)piperidine-3-carboxamide
SMILESNNc1ncc(F)c(N2CCCC(C(N)=O)C2)n1
InChIInChI=1S/C10H15FN6O/c11-7-4-14-10(16-13)15-9(7)17-3-1-2-6(5-17)8(12)18/h4,6H,1-3,5,13H2,(H2,12,18)(H,14,15,16)
InChIKeyRYCKHLGCBOGAMO-UHFFFAOYSA-N
MW254.27 g/mol
LogP-0.40
Rot. Bonds3

About 1-(5-fluoro-2-hydrazinylpyrimidin-4-yl)piperidine-3-carboxamide

1-(5-fluoro-2-hydrazinylpyrimidin-4-yl)piperidine-3-carboxamide (PubChem CID 80918438) has the molecular formula C10H15FN6O and a molecular weight of 254.27 g/mol. Its IUPAC name is 1-(5-fluoro-2-hydrazinylpyrimidin-4-yl)piperidine-3-carboxamide.

Molecular Properties

Compound Name1-(5-fluoro-2-hydrazinylpyrimidin-4-yl)piperidine-3-carboxamide
PubChem CID80918438
Molecular FormulaC10H15FN6O
Molecular Weight254.27 g/mol
Exact Mass254.13
IUPAC Name1-(5-fluoro-2-hydrazinylpyrimidin-4-yl)piperidine-3-carboxamide
SMILESNNc1ncc(F)c(N2CCCC(C(N)=O)C2)n1
InChIInChI=1S/C10H15FN6O/c11-7-4-14-10(16-13)15-9(7)17-3-1-2-6(5-17)8(12)18/h4,6H,1-3,5,13H2,(H2,12,18)(H,14,15,16)
InChIKeyRYCKHLGCBOGAMO-UHFFFAOYSA-N
XLogP-0.40
TPSA110.16 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.27
LogP ≤ 5-0.40
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

[4-(1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)-5-fluoropyrimidin-2-yl]hydrazine
CID 80930087
[5-fluoro-4-(4-methylazepan-1-yl)pyrimidin-2-yl]hydrazine
CID 80910776
1-(5-fluoro-2-hydrazinylpyrimidin-4-yl)pyrrolidine-3,4-diol
CID 106674672
1-[2-(ethylamino)-5-methylpyrimidin-4-yl]piperidine-3-carboxamide
CID 80756566
1-(2-hydrazinyl-6-methylthieno[2,3-d]pyrimidin-4-yl)piperidine-3-carboxamide
CID 103333914
1-[2-(ethylamino)-5-fluoropyrimidin-4-yl]piperidine-4-carboxamide
CID 80754583
[5-fluoro-4-(4-propylazepan-1-yl)pyrimidin-2-yl]hydrazine
CID 80917723
1-(5-fluoro-2-hydrazinylpyrimidin-4-yl)-N-methylpyrrolidine-2-carboxamide
CID 80905623
1-[5-fluoro-2-(propylamino)pyrimidin-4-yl]piperidine-4-carboxamide
CID 80754662
1-(5-aminopyrimidin-4-yl)piperidine-3-carboxamide
CID 79910682
1-(5-bromo-2-chloropyrimidin-4-yl)piperidine-3-carboxamide
CID 79075744
[5-fluoro-4-(4-methylpiperazin-1-yl)pyrimidin-2-yl]hydrazine
CID 80927536

Frequently Asked Questions

What is the IUPAC name of 1-(5-fluoro-2-hydrazinylpyrimidin-4-yl)piperidine-3-carboxamide?
The IUPAC name of 1-(5-fluoro-2-hydrazinylpyrimidin-4-yl)piperidine-3-carboxamide (CID 80918438) is 1-(5-fluoro-2-hydrazinylpyrimidin-4-yl)piperidine-3-carboxamide.
What is the SMILES notation for 1-(5-fluoro-2-hydrazinylpyrimidin-4-yl)piperidine-3-carboxamide?
The canonical SMILES for 1-(5-fluoro-2-hydrazinylpyrimidin-4-yl)piperidine-3-carboxamide is NNc1ncc(F)c(N2CCCC(C(N)=O)C2)n1.
What is the InChIKey of 1-(5-fluoro-2-hydrazinylpyrimidin-4-yl)piperidine-3-carboxamide?
The InChIKey is RYCKHLGCBOGAMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15FN6O/c11-7-4-14-10(16-13)15-9(7)17-3-1-2-6(5-17)8(12)18/h4,6H,1-3,5,13H2,(H2,12,18)(H,14,15,16).
What are the key properties of 1-(5-fluoro-2-hydrazinylpyrimidin-4-yl)piperidine-3-carboxamide?
1-(5-fluoro-2-hydrazinylpyrimidin-4-yl)piperidine-3-carboxamide has a molecular weight of 254.27 g/mol, XLogP of -0.40, 3 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-fluoro-2-hydrazinylpyrimidin-4-yl)piperidine-3-carboxamide is sourced from PubChem (CID 80918438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).