[(2-chloro-3-methylphenyl)-(1-methylpyrazol-3-yl)methyl]hydrazine

C12H15ClN4 — CID 103140793

IUPAC[(2-chloro-3-methylphenyl)-(1-methylpyrazol-3-yl)methyl]hydrazine
SMILESCc1cccc(C(NN)c2ccn(C)n2)c1Cl
InChIInChI=1S/C12H15ClN4/c1-8-4-3-5-9(11(8)13)12(15-14)10-6-7-17(2)16-10/h3-7,12,15H,14H2,1-2H3
InChIKeyOMZHYYJHQCENOM-UHFFFAOYSA-N
MW250.73 g/mol
LogP1.93
Rot. Bonds3

About [(2-chloro-3-methylphenyl)-(1-methylpyrazol-3-yl)methyl]hydrazine

[(2-chloro-3-methylphenyl)-(1-methylpyrazol-3-yl)methyl]hydrazine (PubChem CID 103140793) has the molecular formula C12H15ClN4 and a molecular weight of 250.73 g/mol. Its IUPAC name is [(2-chloro-3-methylphenyl)-(1-methylpyrazol-3-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(2-chloro-3-methylphenyl)-(1-methylpyrazol-3-yl)methyl]hydrazine
PubChem CID103140793
Molecular FormulaC12H15ClN4
Molecular Weight250.73 g/mol
Exact Mass250.10
IUPAC Name[(2-chloro-3-methylphenyl)-(1-methylpyrazol-3-yl)methyl]hydrazine
SMILESCc1cccc(C(NN)c2ccn(C)n2)c1Cl
InChIInChI=1S/C12H15ClN4/c1-8-4-3-5-9(11(8)13)12(15-14)10-6-7-17(2)16-10/h3-7,12,15H,14H2,1-2H3
InChIKeyOMZHYYJHQCENOM-UHFFFAOYSA-N
XLogP1.93
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.73
LogP ≤ 51.93
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

[(2-chloro-3-fluorophenyl)-(1-methylpyrazol-3-yl)methyl]hydrazine
CID 103141046
[(3-chloro-2-methylphenyl)-(1-methylpyrazol-3-yl)methyl]hydrazine
CID 107103871
[(2,3-difluorophenyl)-(1-methylpyrazol-3-yl)methyl]hydrazine
CID 105228669
[(2,4-dimethylphenyl)-(1-methylpyrazol-3-yl)methyl]hydrazine
CID 105228647
[(2,4-difluoro-5-methylphenyl)-(1-methylpyrazol-3-yl)methyl]hydrazine
CID 103141162
[(2-chloro-3-methylphenyl)-pyrazin-2-ylmethyl]hydrazine
CID 105308730
[(2-chloro-6-fluorophenyl)-(1-methylpyrazol-3-yl)methyl]hydrazine
CID 103140976
[(2-chloro-3-methylphenyl)-thiophen-2-ylmethyl]hydrazine
CID 105287597
1-(2-chlorophenyl)-N-methyl-1-(1-methylpyrazol-3-yl)methanamine
CID 65200322
[2-(2,6-dimethylphenyl)-1-(1-methylpyrazol-3-yl)ethyl]hydrazine
CID 105228751
N-[(2-methylphenyl)-(1-methylpyrazol-3-yl)methyl]ethanamine
CID 65200482
4-[hydrazinyl-(1-methylpyrazol-3-yl)methyl]-1-methylpyrazol-5-amine
CID 103140235

Frequently Asked Questions

What is the IUPAC name of [(2-chloro-3-methylphenyl)-(1-methylpyrazol-3-yl)methyl]hydrazine?
The IUPAC name of [(2-chloro-3-methylphenyl)-(1-methylpyrazol-3-yl)methyl]hydrazine (CID 103140793) is [(2-chloro-3-methylphenyl)-(1-methylpyrazol-3-yl)methyl]hydrazine.
What is the SMILES notation for [(2-chloro-3-methylphenyl)-(1-methylpyrazol-3-yl)methyl]hydrazine?
The canonical SMILES for [(2-chloro-3-methylphenyl)-(1-methylpyrazol-3-yl)methyl]hydrazine is Cc1cccc(C(NN)c2ccn(C)n2)c1Cl.
What is the InChIKey of [(2-chloro-3-methylphenyl)-(1-methylpyrazol-3-yl)methyl]hydrazine?
The InChIKey is OMZHYYJHQCENOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15ClN4/c1-8-4-3-5-9(11(8)13)12(15-14)10-6-7-17(2)16-10/h3-7,12,15H,14H2,1-2H3.
What are the key properties of [(2-chloro-3-methylphenyl)-(1-methylpyrazol-3-yl)methyl]hydrazine?
[(2-chloro-3-methylphenyl)-(1-methylpyrazol-3-yl)methyl]hydrazine has a molecular weight of 250.73 g/mol, XLogP of 1.93, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(2-chloro-3-methylphenyl)-(1-methylpyrazol-3-yl)methyl]hydrazine is sourced from PubChem (CID 103140793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).