[(4-chloro-1-ethylpyrazol-5-yl)-phenylmethyl]hydrazine

C12H15ClN4 — CID 105199252

IUPAC[(4-chloro-1-ethylpyrazol-5-yl)-phenylmethyl]hydrazine
SMILESCCn1ncc(Cl)c1C(NN)c1ccccc1
InChIInChI=1S/C12H15ClN4/c1-2-17-12(10(13)8-15-17)11(16-14)9-6-4-3-5-7-9/h3-8,11,16H,2,14H2,1H3
InChIKeyHUXTVRUUXXIOSA-UHFFFAOYSA-N
MW250.73 g/mol
LogP2.11
Rot. Bonds4

About [(4-chloro-1-ethylpyrazol-5-yl)-phenylmethyl]hydrazine

[(4-chloro-1-ethylpyrazol-5-yl)-phenylmethyl]hydrazine (PubChem CID 105199252) has the molecular formula C12H15ClN4 and a molecular weight of 250.73 g/mol. Its IUPAC name is [(4-chloro-1-ethylpyrazol-5-yl)-phenylmethyl]hydrazine.

Molecular Properties

Compound Name[(4-chloro-1-ethylpyrazol-5-yl)-phenylmethyl]hydrazine
PubChem CID105199252
Molecular FormulaC12H15ClN4
Molecular Weight250.73 g/mol
Exact Mass250.10
IUPAC Name[(4-chloro-1-ethylpyrazol-5-yl)-phenylmethyl]hydrazine
SMILESCCn1ncc(Cl)c1C(NN)c1ccccc1
InChIInChI=1S/C12H15ClN4/c1-2-17-12(10(13)8-15-17)11(16-14)9-6-4-3-5-7-9/h3-8,11,16H,2,14H2,1H3
InChIKeyHUXTVRUUXXIOSA-UHFFFAOYSA-N
XLogP2.11
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.73
LogP ≤ 52.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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-ethylpyrazol-5-yl)-(3-chloro-4-fluorophenyl)methyl]hydrazine
CID 105218119
[(4-chloro-1-ethylpyrazol-5-yl)-(3,4-difluorophenyl)methyl]hydrazine
CID 105197082
[(4-chloro-1-ethylpyrazol-5-yl)-(3,4-dimethoxyphenyl)methyl]hydrazine
CID 105192162
[(4-chloro-1-ethylpyrazol-5-yl)-(5-fluoro-3-pyridinyl)methyl]hydrazine
CID 105336447
[(4-chloro-1-ethylpyrazol-5-yl)-(5-methylpyrimidin-2-yl)methyl]hydrazine
CID 105261506
[(4-chloro-1-propylpyrazol-5-yl)-(4-propan-2-ylphenyl)methyl]hydrazine
CID 105194048
1-(4-chloro-1-ethylpyrazol-5-yl)-2-methoxy-2-phenylethanamine
CID 114662146
[(4-chloro-1-ethylpyrazol-5-yl)-(2,4,6-trifluorophenyl)methyl]hydrazine
CID 105336403
1-(4-chloro-1-ethylpyrazol-5-yl)-1-(4-chlorophenyl)-N-methylmethanamine
CID 114646347
[(4-chloro-1-ethylpyrazol-5-yl)-(2,5-dimethylfuran-3-yl)methyl]hydrazine
CID 105336355
[(2-bromo-4-fluorophenyl)-(4-chloro-1-ethylpyrazol-5-yl)methyl]hydrazine
CID 105336356
[(4-chloro-1-ethylpyrazol-5-yl)-(4-chloro-2-methoxyphenyl)methyl]hydrazine
CID 105336455

Frequently Asked Questions

What is the IUPAC name of [(4-chloro-1-ethylpyrazol-5-yl)-phenylmethyl]hydrazine?
The IUPAC name of [(4-chloro-1-ethylpyrazol-5-yl)-phenylmethyl]hydrazine (CID 105199252) is [(4-chloro-1-ethylpyrazol-5-yl)-phenylmethyl]hydrazine.
What is the SMILES notation for [(4-chloro-1-ethylpyrazol-5-yl)-phenylmethyl]hydrazine?
The canonical SMILES for [(4-chloro-1-ethylpyrazol-5-yl)-phenylmethyl]hydrazine is CCn1ncc(Cl)c1C(NN)c1ccccc1.
What is the InChIKey of [(4-chloro-1-ethylpyrazol-5-yl)-phenylmethyl]hydrazine?
The InChIKey is HUXTVRUUXXIOSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15ClN4/c1-2-17-12(10(13)8-15-17)11(16-14)9-6-4-3-5-7-9/h3-8,11,16H,2,14H2,1H3.
What are the key properties of [(4-chloro-1-ethylpyrazol-5-yl)-phenylmethyl]hydrazine?
[(4-chloro-1-ethylpyrazol-5-yl)-phenylmethyl]hydrazine has a molecular weight of 250.73 g/mol, XLogP of 2.11, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(4-chloro-1-ethylpyrazol-5-yl)-phenylmethyl]hydrazine is sourced from PubChem (CID 105199252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).