[[4-chloro-1-(2-methoxyethyl)pyrazol-5-yl]-(5-methylfuran-3-yl)methyl]hydrazine

C12H17ClN4O2 — CID 105342375

IUPAC[[4-chloro-1-(2-methoxyethyl)pyrazol-5-yl]-(5-methylfuran-3-yl)methyl]hydrazine
SMILESCOCCn1ncc(Cl)c1C(NN)c1coc(C)c1
InChIInChI=1S/C12H17ClN4O2/c1-8-5-9(7-19-8)11(16-14)12-10(13)6-15-17(12)3-4-18-2/h5-7,11,16H,3-4,14H2,1-2H3
InChIKeyNEIZUFMLFGHXGF-UHFFFAOYSA-N
MW284.75 g/mol
LogP1.64
Rot. Bonds6

About [[4-chloro-1-(2-methoxyethyl)pyrazol-5-yl]-(5-methylfuran-3-yl)methyl]hydrazine

[[4-chloro-1-(2-methoxyethyl)pyrazol-5-yl]-(5-methylfuran-3-yl)methyl]hydrazine (PubChem CID 105342375) has the molecular formula C12H17ClN4O2 and a molecular weight of 284.75 g/mol. Its IUPAC name is [[4-chloro-1-(2-methoxyethyl)pyrazol-5-yl]-(5-methylfuran-3-yl)methyl]hydrazine.

Molecular Properties

Compound Name[[4-chloro-1-(2-methoxyethyl)pyrazol-5-yl]-(5-methylfuran-3-yl)methyl]hydrazine
PubChem CID105342375
Molecular FormulaC12H17ClN4O2
Molecular Weight284.75 g/mol
Exact Mass284.10
IUPAC Name[[4-chloro-1-(2-methoxyethyl)pyrazol-5-yl]-(5-methylfuran-3-yl)methyl]hydrazine
SMILESCOCCn1ncc(Cl)c1C(NN)c1coc(C)c1
InChIInChI=1S/C12H17ClN4O2/c1-8-5-9(7-19-8)11(16-14)12-10(13)6-15-17(12)3-4-18-2/h5-7,11,16H,3-4,14H2,1-2H3
InChIKeyNEIZUFMLFGHXGF-UHFFFAOYSA-N
XLogP1.64
TPSA78.24 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.75
LogP ≤ 51.64
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-chloro-1-(2-methoxyethyl)pyrazol-5-yl]-(4-chloro-3-methylphenyl)methyl]hydrazine
CID 105342343
4-bromo-2-[[4-chloro-1-(2-methoxyethyl)pyrazol-5-yl]-hydrazinylmethyl]aniline
CID 105263440
[[4-chloro-1-(2-methoxyethyl)pyrazol-5-yl]-(4,5-dibromothiophen-2-yl)methyl]hydrazine
CID 105342423
2-[4-chloro-5-[methylamino-(5-methylfuran-3-yl)methyl]pyrazol-1-yl]-N,N-dimethylethanamine
CID 105038992
[1-[4-chloro-1-(2-methoxyethyl)pyrazol-5-yl]-2,2-difluoroethyl]hydrazine
CID 105265036
[(2-bromo-4-fluorophenyl)-[4-chloro-1-(2-methoxyethyl)pyrazol-5-yl]methyl]hydrazine
CID 105342355
[[4-bromo-1-(2-methoxyethyl)pyrazol-5-yl]-(3-chloro-5-methylphenyl)methyl]hydrazine
CID 105337269
1-[4-chloro-1-(2-methoxyethyl)pyrazol-5-yl]butylhydrazine
CID 105202075
N-[[4-chloro-1-(2-methoxyethyl)pyrazol-5-yl]-(furan-3-yl)methyl]ethanamine
CID 114652418
[[4-bromo-1-(2-methoxyethyl)pyrazol-5-yl]-(4-methoxyphenyl)methyl]hydrazine
CID 105190947
[(2-bromo-6-fluorophenyl)-[4-chloro-1-(2-methoxyethyl)pyrazol-5-yl]methyl]hydrazine
CID 105280354
[1-[4-chloro-1-(2-methoxyethyl)pyrazol-5-yl]-2-methylpentyl]hydrazine
CID 105342381

Frequently Asked Questions

What is the IUPAC name of [[4-chloro-1-(2-methoxyethyl)pyrazol-5-yl]-(5-methylfuran-3-yl)methyl]hydrazine?
The IUPAC name of [[4-chloro-1-(2-methoxyethyl)pyrazol-5-yl]-(5-methylfuran-3-yl)methyl]hydrazine (CID 105342375) is [[4-chloro-1-(2-methoxyethyl)pyrazol-5-yl]-(5-methylfuran-3-yl)methyl]hydrazine.
What is the SMILES notation for [[4-chloro-1-(2-methoxyethyl)pyrazol-5-yl]-(5-methylfuran-3-yl)methyl]hydrazine?
The canonical SMILES for [[4-chloro-1-(2-methoxyethyl)pyrazol-5-yl]-(5-methylfuran-3-yl)methyl]hydrazine is COCCn1ncc(Cl)c1C(NN)c1coc(C)c1.
What is the InChIKey of [[4-chloro-1-(2-methoxyethyl)pyrazol-5-yl]-(5-methylfuran-3-yl)methyl]hydrazine?
The InChIKey is NEIZUFMLFGHXGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17ClN4O2/c1-8-5-9(7-19-8)11(16-14)12-10(13)6-15-17(12)3-4-18-2/h5-7,11,16H,3-4,14H2,1-2H3.
What are the key properties of [[4-chloro-1-(2-methoxyethyl)pyrazol-5-yl]-(5-methylfuran-3-yl)methyl]hydrazine?
[[4-chloro-1-(2-methoxyethyl)pyrazol-5-yl]-(5-methylfuran-3-yl)methyl]hydrazine has a molecular weight of 284.75 g/mol, XLogP of 1.64, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [[4-chloro-1-(2-methoxyethyl)pyrazol-5-yl]-(5-methylfuran-3-yl)methyl]hydrazine is sourced from PubChem (CID 105342375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).