[1-chloro-1,1-difluoro-3-(4-methyl-1,3-thiazol-2-yl)propan-2-yl]hydrazine

C7H10ClF2N3S — CID 105265468

IUPAC[1-chloro-1,1-difluoro-3-(4-methyl-1,3-thiazol-2-yl)propan-2-yl]hydrazine
SMILESCc1csc(CC(NN)C(F)(F)Cl)n1
InChIInChI=1S/C7H10ClF2N3S/c1-4-3-14-6(12-4)2-5(13-11)7(8,9)10/h3,5,13H,2,11H2,1H3
InChIKeyIQZSVSLVQGPNRM-UHFFFAOYSA-N
MW241.69 g/mol
LogP1.66
Rot. Bonds4

About [1-chloro-1,1-difluoro-3-(4-methyl-1,3-thiazol-2-yl)propan-2-yl]hydrazine

[1-chloro-1,1-difluoro-3-(4-methyl-1,3-thiazol-2-yl)propan-2-yl]hydrazine (PubChem CID 105265468) has the molecular formula C7H10ClF2N3S and a molecular weight of 241.69 g/mol. Its IUPAC name is [1-chloro-1,1-difluoro-3-(4-methyl-1,3-thiazol-2-yl)propan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-chloro-1,1-difluoro-3-(4-methyl-1,3-thiazol-2-yl)propan-2-yl]hydrazine
PubChem CID105265468
Molecular FormulaC7H10ClF2N3S
Molecular Weight241.69 g/mol
Exact Mass241.03
IUPAC Name[1-chloro-1,1-difluoro-3-(4-methyl-1,3-thiazol-2-yl)propan-2-yl]hydrazine
SMILESCc1csc(CC(NN)C(F)(F)Cl)n1
InChIInChI=1S/C7H10ClF2N3S/c1-4-3-14-6(12-4)2-5(13-11)7(8,9)10/h3,5,13H,2,11H2,1H3
InChIKeyIQZSVSLVQGPNRM-UHFFFAOYSA-N
XLogP1.66
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.69
LogP ≤ 51.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [1-chloro-1,1-difluoro-3-(4-methyl-1,3-thiazol-2-yl)propan-2-yl]hydrazine?
The IUPAC name of [1-chloro-1,1-difluoro-3-(4-methyl-1,3-thiazol-2-yl)propan-2-yl]hydrazine (CID 105265468) is [1-chloro-1,1-difluoro-3-(4-methyl-1,3-thiazol-2-yl)propan-2-yl]hydrazine.
What is the SMILES notation for [1-chloro-1,1-difluoro-3-(4-methyl-1,3-thiazol-2-yl)propan-2-yl]hydrazine?
The canonical SMILES for [1-chloro-1,1-difluoro-3-(4-methyl-1,3-thiazol-2-yl)propan-2-yl]hydrazine is Cc1csc(CC(NN)C(F)(F)Cl)n1.
What is the InChIKey of [1-chloro-1,1-difluoro-3-(4-methyl-1,3-thiazol-2-yl)propan-2-yl]hydrazine?
The InChIKey is IQZSVSLVQGPNRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10ClF2N3S/c1-4-3-14-6(12-4)2-5(13-11)7(8,9)10/h3,5,13H,2,11H2,1H3.
What are the key properties of [1-chloro-1,1-difluoro-3-(4-methyl-1,3-thiazol-2-yl)propan-2-yl]hydrazine?
[1-chloro-1,1-difluoro-3-(4-methyl-1,3-thiazol-2-yl)propan-2-yl]hydrazine has a molecular weight of 241.69 g/mol, XLogP of 1.66, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-chloro-1,1-difluoro-3-(4-methyl-1,3-thiazol-2-yl)propan-2-yl]hydrazine is sourced from PubChem (CID 105265468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).