[(1-ethyl-4-methoxypyrazol-5-yl)-(4-ethylsulfanylphenyl)methyl]hydrazine

C15H22N4OS — CID 106850526

IUPAC[(1-ethyl-4-methoxypyrazol-5-yl)-(4-ethylsulfanylphenyl)methyl]hydrazine
SMILESCCSc1ccc(C(NN)c2c(OC)cnn2CC)cc1
InChIInChI=1S/C15H22N4OS/c1-4-19-15(13(20-3)10-17-19)14(18-16)11-6-8-12(9-7-11)21-5-2/h6-10,14,18H,4-5,16H2,1-3H3
InChIKeyROPWDGRGWMIADD-UHFFFAOYSA-N
MW306.44 g/mol
LogP2.58
Rot. Bonds7

About [(1-ethyl-4-methoxypyrazol-5-yl)-(4-ethylsulfanylphenyl)methyl]hydrazine

[(1-ethyl-4-methoxypyrazol-5-yl)-(4-ethylsulfanylphenyl)methyl]hydrazine (PubChem CID 106850526) has the molecular formula C15H22N4OS and a molecular weight of 306.44 g/mol. Its IUPAC name is [(1-ethyl-4-methoxypyrazol-5-yl)-(4-ethylsulfanylphenyl)methyl]hydrazine.

Molecular Properties

Compound Name[(1-ethyl-4-methoxypyrazol-5-yl)-(4-ethylsulfanylphenyl)methyl]hydrazine
PubChem CID106850526
Molecular FormulaC15H22N4OS
Molecular Weight306.44 g/mol
Exact Mass306.15
IUPAC Name[(1-ethyl-4-methoxypyrazol-5-yl)-(4-ethylsulfanylphenyl)methyl]hydrazine
SMILESCCSc1ccc(C(NN)c2c(OC)cnn2CC)cc1
InChIInChI=1S/C15H22N4OS/c1-4-19-15(13(20-3)10-17-19)14(18-16)11-6-8-12(9-7-11)21-5-2/h6-10,14,18H,4-5,16H2,1-3H3
InChIKeyROPWDGRGWMIADD-UHFFFAOYSA-N
XLogP2.58
TPSA65.10 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.44
LogP ≤ 52.58
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

[(4-methoxy-1-propylpyrazol-5-yl)-(4-methylsulfanylphenyl)methyl]hydrazine
CID 105339854
1-(4-ethylsulfanylphenyl)-1-(4-methoxy-1-methylpyrazol-5-yl)-N-methylmethanamine
CID 106848978
[(2,3-dichlorophenyl)-(1-ethyl-4-methoxypyrazol-5-yl)methyl]hydrazine
CID 105339380
[(4-chloro-1-ethylpyrazol-5-yl)-(3,4-dimethoxyphenyl)methyl]hydrazine
CID 105192162
[(1-ethyl-4-methoxypyrazol-5-yl)-(2-methylpyrazol-3-yl)methyl]hydrazine
CID 105339343
[(3-chlorothiophen-2-yl)-(1-ethyl-4-methoxypyrazol-5-yl)methyl]hydrazine
CID 105339350
[(3,4-dichlorophenyl)-(4-methoxy-1-propylpyrazol-5-yl)methyl]hydrazine
CID 105257120
[(2,6-dimethyl-3-pyridinyl)-(1-ethyl-4-methoxypyrazol-5-yl)methyl]hydrazine
CID 105339360
N-[(4-bromophenyl)-(1-ethyl-4-methoxypyrazol-5-yl)methyl]ethanamine
CID 114646936
[(2,5-dibromophenyl)-(1-ethyl-4-methoxypyrazol-5-yl)methyl]hydrazine
CID 105339423
[(1-ethyl-4-methoxypyrazol-5-yl)-(1,2,5-thiadiazol-3-yl)methyl]hydrazine
CID 105339368
N-[(1-ethyl-4-methoxypyrazol-5-yl)-(4-methylphenyl)methyl]propan-1-amine
CID 114646984

Frequently Asked Questions

What is the IUPAC name of [(1-ethyl-4-methoxypyrazol-5-yl)-(4-ethylsulfanylphenyl)methyl]hydrazine?
The IUPAC name of [(1-ethyl-4-methoxypyrazol-5-yl)-(4-ethylsulfanylphenyl)methyl]hydrazine (CID 106850526) is [(1-ethyl-4-methoxypyrazol-5-yl)-(4-ethylsulfanylphenyl)methyl]hydrazine.
What is the SMILES notation for [(1-ethyl-4-methoxypyrazol-5-yl)-(4-ethylsulfanylphenyl)methyl]hydrazine?
The canonical SMILES for [(1-ethyl-4-methoxypyrazol-5-yl)-(4-ethylsulfanylphenyl)methyl]hydrazine is CCSc1ccc(C(NN)c2c(OC)cnn2CC)cc1.
What is the InChIKey of [(1-ethyl-4-methoxypyrazol-5-yl)-(4-ethylsulfanylphenyl)methyl]hydrazine?
The InChIKey is ROPWDGRGWMIADD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4OS/c1-4-19-15(13(20-3)10-17-19)14(18-16)11-6-8-12(9-7-11)21-5-2/h6-10,14,18H,4-5,16H2,1-3H3.
What are the key properties of [(1-ethyl-4-methoxypyrazol-5-yl)-(4-ethylsulfanylphenyl)methyl]hydrazine?
[(1-ethyl-4-methoxypyrazol-5-yl)-(4-ethylsulfanylphenyl)methyl]hydrazine has a molecular weight of 306.44 g/mol, XLogP of 2.58, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [(1-ethyl-4-methoxypyrazol-5-yl)-(4-ethylsulfanylphenyl)methyl]hydrazine is sourced from PubChem (CID 106850526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).