[4-[(4,5-dimethyl-1,3-oxazol-2-yl)sulfanyl]-5-fluoropyrimidin-2-yl]hydrazine

C9H10FN5OS — CID 106928866

IUPAC[4-[(4,5-dimethyl-1,3-oxazol-2-yl)sulfanyl]-5-fluoropyrimidin-2-yl]hydrazine
SMILESCc1nc(Sc2nc(NN)ncc2F)oc1C
InChIInChI=1S/C9H10FN5OS/c1-4-5(2)16-9(13-4)17-7-6(10)3-12-8(14-7)15-11/h3H,11H2,1-2H3,(H,12,14,15)
InChIKeyFKMGNFKPQIONGK-UHFFFAOYSA-N
MW255.28 g/mol
LogP1.66
Rot. Bonds3

About [4-[(4,5-dimethyl-1,3-oxazol-2-yl)sulfanyl]-5-fluoropyrimidin-2-yl]hydrazine

[4-[(4,5-dimethyl-1,3-oxazol-2-yl)sulfanyl]-5-fluoropyrimidin-2-yl]hydrazine (PubChem CID 106928866) has the molecular formula C9H10FN5OS and a molecular weight of 255.28 g/mol. Its IUPAC name is [4-[(4,5-dimethyl-1,3-oxazol-2-yl)sulfanyl]-5-fluoropyrimidin-2-yl]hydrazine.

Molecular Properties

Compound Name[4-[(4,5-dimethyl-1,3-oxazol-2-yl)sulfanyl]-5-fluoropyrimidin-2-yl]hydrazine
PubChem CID106928866
Molecular FormulaC9H10FN5OS
Molecular Weight255.28 g/mol
Exact Mass255.06
IUPAC Name[4-[(4,5-dimethyl-1,3-oxazol-2-yl)sulfanyl]-5-fluoropyrimidin-2-yl]hydrazine
SMILESCc1nc(Sc2nc(NN)ncc2F)oc1C
InChIInChI=1S/C9H10FN5OS/c1-4-5(2)16-9(13-4)17-7-6(10)3-12-8(14-7)15-11/h3H,11H2,1-2H3,(H,12,14,15)
InChIKeyFKMGNFKPQIONGK-UHFFFAOYSA-N
XLogP1.66
TPSA89.86 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.28
LogP ≤ 51.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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

2-(2-Chloro-5-fluoropyrimidin-4-yl)sulfanyl-4-methyl-1,3-oxazole
CID 106923484
2-(6-Fluoropyrimidin-4-yl)sulfanyl-4,5-dimethyl-1,3-oxazole
CID 106923496
2-(2-Chloro-5-fluoropyrimidin-4-yl)sulfanyl-4,5-dimethyl-1,3-oxazole
CID 106923555
5-fluoro-N-methyl-4-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]pyrimidin-2-amine
CID 106928448
5-fluoro-4-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]-N-propylpyrimidin-2-amine
CID 106928449
5-Fluoro-4-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]pyrimidin-2-amine
CID 106928514
4-[(4,5-dimethyl-1,3-oxazol-2-yl)sulfanyl]-5-fluoro-N-propylpyrimidin-2-amine
CID 106928632
4-[(4,5-Dimethyl-1,3-oxazol-2-yl)sulfanyl]-5-fluoropyrimidin-2-amine
CID 106928693
4-[(4,5-dimethyl-1,3-oxazol-2-yl)sulfanyl]-N-ethyl-5-fluoropyrimidin-2-amine
CID 106928721
[5-Fluoro-4-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]pyrimidin-2-yl]hydrazine
CID 106928815
N-ethyl-5-fluoro-4-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]pyrimidin-2-amine
CID 113894301
4-[(4,5-dimethyl-1,3-oxazol-2-yl)sulfanyl]-5-fluoro-N-methylpyrimidin-2-amine
CID 113894316

Frequently Asked Questions

What is the IUPAC name of [4-[(4,5-dimethyl-1,3-oxazol-2-yl)sulfanyl]-5-fluoropyrimidin-2-yl]hydrazine?
The IUPAC name of [4-[(4,5-dimethyl-1,3-oxazol-2-yl)sulfanyl]-5-fluoropyrimidin-2-yl]hydrazine (CID 106928866) is [4-[(4,5-dimethyl-1,3-oxazol-2-yl)sulfanyl]-5-fluoropyrimidin-2-yl]hydrazine.
What is the SMILES notation for [4-[(4,5-dimethyl-1,3-oxazol-2-yl)sulfanyl]-5-fluoropyrimidin-2-yl]hydrazine?
The canonical SMILES for [4-[(4,5-dimethyl-1,3-oxazol-2-yl)sulfanyl]-5-fluoropyrimidin-2-yl]hydrazine is Cc1nc(Sc2nc(NN)ncc2F)oc1C.
What is the InChIKey of [4-[(4,5-dimethyl-1,3-oxazol-2-yl)sulfanyl]-5-fluoropyrimidin-2-yl]hydrazine?
The InChIKey is FKMGNFKPQIONGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10FN5OS/c1-4-5(2)16-9(13-4)17-7-6(10)3-12-8(14-7)15-11/h3H,11H2,1-2H3,(H,12,14,15).
What are the key properties of [4-[(4,5-dimethyl-1,3-oxazol-2-yl)sulfanyl]-5-fluoropyrimidin-2-yl]hydrazine?
[4-[(4,5-dimethyl-1,3-oxazol-2-yl)sulfanyl]-5-fluoropyrimidin-2-yl]hydrazine has a molecular weight of 255.28 g/mol, XLogP of 1.66, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[(4,5-dimethyl-1,3-oxazol-2-yl)sulfanyl]-5-fluoropyrimidin-2-yl]hydrazine is sourced from PubChem (CID 106928866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).