[(4-bromo-1-propylpyrazol-5-yl)-(3-chloro-4-methylthiophen-2-yl)methyl]hydrazine

C12H16BrClN4S — CID 103408784

IUPAC[(4-bromo-1-propylpyrazol-5-yl)-(3-chloro-4-methylthiophen-2-yl)methyl]hydrazine
SMILESCCCn1ncc(Br)c1C(NN)c1scc(C)c1Cl
InChIInChI=1S/C12H16BrClN4S/c1-3-4-18-11(8(13)5-16-18)10(17-15)12-9(14)7(2)6-19-12/h5-6,10,17H,3-4,15H2,1-2H3
InChIKeyLSIPQVDUTKWLNM-UHFFFAOYSA-N
MW363.71 g/mol
LogP3.63
Rot. Bonds5

About [(4-bromo-1-propylpyrazol-5-yl)-(3-chloro-4-methylthiophen-2-yl)methyl]hydrazine

[(4-bromo-1-propylpyrazol-5-yl)-(3-chloro-4-methylthiophen-2-yl)methyl]hydrazine (PubChem CID 103408784) has the molecular formula C12H16BrClN4S and a molecular weight of 363.71 g/mol. Its IUPAC name is [(4-bromo-1-propylpyrazol-5-yl)-(3-chloro-4-methylthiophen-2-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(4-bromo-1-propylpyrazol-5-yl)-(3-chloro-4-methylthiophen-2-yl)methyl]hydrazine
PubChem CID103408784
Molecular FormulaC12H16BrClN4S
Molecular Weight363.71 g/mol
Exact Mass362.00
IUPAC Name[(4-bromo-1-propylpyrazol-5-yl)-(3-chloro-4-methylthiophen-2-yl)methyl]hydrazine
SMILESCCCn1ncc(Br)c1C(NN)c1scc(C)c1Cl
InChIInChI=1S/C12H16BrClN4S/c1-3-4-18-11(8(13)5-16-18)10(17-15)12-9(14)7(2)6-19-12/h5-6,10,17H,3-4,15H2,1-2H3
InChIKeyLSIPQVDUTKWLNM-UHFFFAOYSA-N
XLogP3.63
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.71
LogP ≤ 53.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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-bromo-1-propylpyrazol-5-yl)-(3-chloro-4-methylthiophen-2-yl)methanol
CID 103408262
1-(4-bromo-1-ethylpyrazol-5-yl)-1-(3-chloro-4-methylthiophen-2-yl)-N-methylmethanamine
CID 103407340
[(4-bromo-1-propylpyrazol-5-yl)-(2,4,6-trimethylphenyl)methyl]hydrazine
CID 105336638
[(4-bromo-1-propylpyrazol-5-yl)-(2-chlorofuran-3-yl)methyl]hydrazine
CID 106694739
[(3-chloro-4-methylthiophen-2-yl)-(1-propylpyrazol-4-yl)methyl]hydrazine
CID 103408427
[(4-bromo-1-propylpyrazol-5-yl)-(4-chloro-3-methylphenyl)methyl]hydrazine
CID 105336612
[(4-bromo-1-propylpyrazol-5-yl)-(1,5-dimethylpyrazol-4-yl)methyl]hydrazine
CID 105336644
[(3-bromo-5-chlorophenyl)-(4-bromo-1-propylpyrazol-5-yl)methyl]hydrazine
CID 114019567
[(4-bromo-1-propylpyrazol-5-yl)-(3-chloro-2-fluorophenyl)methyl]hydrazine
CID 105223487
[(4-bromo-1-propylpyrazol-5-yl)-(3-fluoro-4-methylphenyl)methyl]hydrazine
CID 105201663
[1-(4-bromo-1-propylpyrazol-5-yl)-2-propylpentyl]hydrazine
CID 105336590
[1-(4-bromo-1-propylpyrazol-5-yl)-2-methylpropyl]hydrazine
CID 105199703

Frequently Asked Questions

What is the IUPAC name of [(4-bromo-1-propylpyrazol-5-yl)-(3-chloro-4-methylthiophen-2-yl)methyl]hydrazine?
The IUPAC name of [(4-bromo-1-propylpyrazol-5-yl)-(3-chloro-4-methylthiophen-2-yl)methyl]hydrazine (CID 103408784) is [(4-bromo-1-propylpyrazol-5-yl)-(3-chloro-4-methylthiophen-2-yl)methyl]hydrazine.
What is the SMILES notation for [(4-bromo-1-propylpyrazol-5-yl)-(3-chloro-4-methylthiophen-2-yl)methyl]hydrazine?
The canonical SMILES for [(4-bromo-1-propylpyrazol-5-yl)-(3-chloro-4-methylthiophen-2-yl)methyl]hydrazine is CCCn1ncc(Br)c1C(NN)c1scc(C)c1Cl.
What is the InChIKey of [(4-bromo-1-propylpyrazol-5-yl)-(3-chloro-4-methylthiophen-2-yl)methyl]hydrazine?
The InChIKey is LSIPQVDUTKWLNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16BrClN4S/c1-3-4-18-11(8(13)5-16-18)10(17-15)12-9(14)7(2)6-19-12/h5-6,10,17H,3-4,15H2,1-2H3.
What are the key properties of [(4-bromo-1-propylpyrazol-5-yl)-(3-chloro-4-methylthiophen-2-yl)methyl]hydrazine?
[(4-bromo-1-propylpyrazol-5-yl)-(3-chloro-4-methylthiophen-2-yl)methyl]hydrazine has a molecular weight of 363.71 g/mol, XLogP of 3.63, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [(4-bromo-1-propylpyrazol-5-yl)-(3-chloro-4-methylthiophen-2-yl)methyl]hydrazine is sourced from PubChem (CID 103408784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).