[(4-chloro-1-propylpyrazol-5-yl)-(4-methoxythiophen-2-yl)methyl]hydrazine

C12H17ClN4OS — CID 105337261

IUPAC[(4-chloro-1-propylpyrazol-5-yl)-(4-methoxythiophen-2-yl)methyl]hydrazine
SMILESCCCn1ncc(Cl)c1C(NN)c1cc(OC)cs1
InChIInChI=1S/C12H17ClN4OS/c1-3-4-17-12(9(13)6-15-17)11(16-14)10-5-8(18-2)7-19-10/h5-7,11,16H,3-4,14H2,1-2H3
InChIKeyFJVCUFDNMWLWGV-UHFFFAOYSA-N
MW300.82 g/mol
LogP2.57
Rot. Bonds6

About [(4-chloro-1-propylpyrazol-5-yl)-(4-methoxythiophen-2-yl)methyl]hydrazine

[(4-chloro-1-propylpyrazol-5-yl)-(4-methoxythiophen-2-yl)methyl]hydrazine (PubChem CID 105337261) has the molecular formula C12H17ClN4OS and a molecular weight of 300.82 g/mol. Its IUPAC name is [(4-chloro-1-propylpyrazol-5-yl)-(4-methoxythiophen-2-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(4-chloro-1-propylpyrazol-5-yl)-(4-methoxythiophen-2-yl)methyl]hydrazine
PubChem CID105337261
Molecular FormulaC12H17ClN4OS
Molecular Weight300.82 g/mol
Exact Mass300.08
IUPAC Name[(4-chloro-1-propylpyrazol-5-yl)-(4-methoxythiophen-2-yl)methyl]hydrazine
SMILESCCCn1ncc(Cl)c1C(NN)c1cc(OC)cs1
InChIInChI=1S/C12H17ClN4OS/c1-3-4-17-12(9(13)6-15-17)11(16-14)10-5-8(18-2)7-19-10/h5-7,11,16H,3-4,14H2,1-2H3
InChIKeyFJVCUFDNMWLWGV-UHFFFAOYSA-N
XLogP2.57
TPSA65.10 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.82
LogP ≤ 52.57
H-Bond Donors ≤ 52
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

N-[(4-chloro-1-propylpyrazol-5-yl)-(4-methoxythiophen-2-yl)methyl]propan-1-amine
CID 105042627
[(4-chloro-1-propylpyrazol-5-yl)-thiophen-2-ylmethyl]hydrazine
CID 105193576
2-[5-[amino-(4-methoxythiophen-2-yl)methyl]-4-chloropyrazol-1-yl]-N,N-dimethylethanamine
CID 105039133
[4-chloro-1-(2-methoxyethyl)pyrazol-5-yl]-(4-methoxythiophen-2-yl)methanol
CID 115839360
[(4-chloro-1-propylpyrazol-5-yl)-(4-propan-2-ylphenyl)methyl]hydrazine
CID 105194048
[(3-bromo-4-methoxyphenyl)-(4-chloro-1-propylpyrazol-5-yl)methyl]hydrazine
CID 105337224
[1-benzothiophen-3-yl-(4-chloro-1-propylpyrazol-5-yl)methyl]hydrazine
CID 105337177
[(4-chloro-1-propylpyrazol-5-yl)-(3,4,5-trifluorophenyl)methyl]hydrazine
CID 105208071
[(2-chloro-4-methylphenyl)-(4-chloro-1-propylpyrazol-5-yl)methyl]hydrazine
CID 106860223
[1-(4-chloro-1-propylpyrazol-5-yl)-2,2-dimethoxyethyl]hydrazine
CID 105245955
1-(4-chloro-1-propylpyrazol-5-yl)-N-methyl-1-(1,3-thiazol-5-yl)methanamine
CID 114658603
[(4-chloro-1-propylpyrazol-5-yl)-(2,3-dichlorophenyl)methyl]hydrazine
CID 105337147

Frequently Asked Questions

What is the IUPAC name of [(4-chloro-1-propylpyrazol-5-yl)-(4-methoxythiophen-2-yl)methyl]hydrazine?
The IUPAC name of [(4-chloro-1-propylpyrazol-5-yl)-(4-methoxythiophen-2-yl)methyl]hydrazine (CID 105337261) is [(4-chloro-1-propylpyrazol-5-yl)-(4-methoxythiophen-2-yl)methyl]hydrazine.
What is the SMILES notation for [(4-chloro-1-propylpyrazol-5-yl)-(4-methoxythiophen-2-yl)methyl]hydrazine?
The canonical SMILES for [(4-chloro-1-propylpyrazol-5-yl)-(4-methoxythiophen-2-yl)methyl]hydrazine is CCCn1ncc(Cl)c1C(NN)c1cc(OC)cs1.
What is the InChIKey of [(4-chloro-1-propylpyrazol-5-yl)-(4-methoxythiophen-2-yl)methyl]hydrazine?
The InChIKey is FJVCUFDNMWLWGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17ClN4OS/c1-3-4-17-12(9(13)6-15-17)11(16-14)10-5-8(18-2)7-19-10/h5-7,11,16H,3-4,14H2,1-2H3.
What are the key properties of [(4-chloro-1-propylpyrazol-5-yl)-(4-methoxythiophen-2-yl)methyl]hydrazine?
[(4-chloro-1-propylpyrazol-5-yl)-(4-methoxythiophen-2-yl)methyl]hydrazine has a molecular weight of 300.82 g/mol, XLogP of 2.57, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [(4-chloro-1-propylpyrazol-5-yl)-(4-methoxythiophen-2-yl)methyl]hydrazine is sourced from PubChem (CID 105337261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).