4-[(2-chlorophenyl)-hydrazinylmethyl]-1-methylpyrazol-5-amine

C11H14ClN5 — CID 105230692

IUPAC4-[(2-chlorophenyl)-hydrazinylmethyl]-1-methylpyrazol-5-amine
SMILESCn1ncc(C(NN)c2ccccc2Cl)c1N
InChIInChI=1S/C11H14ClN5/c1-17-11(13)8(6-15-17)10(16-14)7-4-2-3-5-9(7)12/h2-6,10,16H,13-14H2,1H3
InChIKeyVOZQJHGRQLGAOV-UHFFFAOYSA-N
MW251.72 g/mol
LogP1.21
Rot. Bonds3

About 4-[(2-chlorophenyl)-hydrazinylmethyl]-1-methylpyrazol-5-amine

4-[(2-chlorophenyl)-hydrazinylmethyl]-1-methylpyrazol-5-amine (PubChem CID 105230692) has the molecular formula C11H14ClN5 and a molecular weight of 251.72 g/mol. Its IUPAC name is 4-[(2-chlorophenyl)-hydrazinylmethyl]-1-methylpyrazol-5-amine.

Molecular Properties

Compound Name4-[(2-chlorophenyl)-hydrazinylmethyl]-1-methylpyrazol-5-amine
PubChem CID105230692
Molecular FormulaC11H14ClN5
Molecular Weight251.72 g/mol
Exact Mass251.09
IUPAC Name4-[(2-chlorophenyl)-hydrazinylmethyl]-1-methylpyrazol-5-amine
SMILESCn1ncc(C(NN)c2ccccc2Cl)c1N
InChIInChI=1S/C11H14ClN5/c1-17-11(13)8(6-15-17)10(16-14)7-4-2-3-5-9(7)12/h2-6,10,16H,13-14H2,1H3
InChIKeyVOZQJHGRQLGAOV-UHFFFAOYSA-N
XLogP1.21
TPSA81.89 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.72
LogP ≤ 51.21
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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-[(2,3-difluorophenyl)-hydrazinylmethyl]-1-methylpyrazol-5-amine
CID 105230790
3-[(5-amino-1-methylpyrazol-4-yl)-hydrazinylmethyl]-5-chloropyridin-2-amine
CID 105230884
4-[hydrazinyl(isoquinolin-8-yl)methyl]-1-methylpyrazol-5-amine
CID 103140237
4-[hydrazinyl-(4-methyl-3-pyridinyl)methyl]-1-methylpyrazol-5-amine
CID 105230863
4-[(5-fluoro-2-methylphenyl)-hydrazinylmethyl]-1-methylpyrazol-5-amine
CID 105230723
4-[hydrazinyl-(3-phenyltriazol-4-yl)methyl]-1-methylpyrazol-5-amine
CID 105231007
4-[hydrazinyl-(1-methylpyrazol-3-yl)methyl]-1-methylpyrazol-5-amine
CID 103140235
3-[(2-chlorophenyl)-hydrazinylmethyl]-5-methylpyridin-2-amine
CID 105211209
4-[2-(3-chloro-2-fluorophenyl)-1-hydrazinylethyl]-1-methylpyrazol-5-amine
CID 102867831
2-[4-chloro-5-[(2-chlorophenyl)-hydrazinylmethyl]pyrazol-1-yl]-N,N-dimethylethanamine
CID 105211079
4-[(3-bromo-2,4-dimethoxyphenyl)-hydrazinylmethyl]-1-methylpyrazol-5-amine
CID 103524627
[(2-chlorophenyl)-(2,4,5-trimethylphenyl)methyl]hydrazine
CID 105211144

Frequently Asked Questions

What is the IUPAC name of 4-[(2-chlorophenyl)-hydrazinylmethyl]-1-methylpyrazol-5-amine?
The IUPAC name of 4-[(2-chlorophenyl)-hydrazinylmethyl]-1-methylpyrazol-5-amine (CID 105230692) is 4-[(2-chlorophenyl)-hydrazinylmethyl]-1-methylpyrazol-5-amine.
What is the SMILES notation for 4-[(2-chlorophenyl)-hydrazinylmethyl]-1-methylpyrazol-5-amine?
The canonical SMILES for 4-[(2-chlorophenyl)-hydrazinylmethyl]-1-methylpyrazol-5-amine is Cn1ncc(C(NN)c2ccccc2Cl)c1N.
What is the InChIKey of 4-[(2-chlorophenyl)-hydrazinylmethyl]-1-methylpyrazol-5-amine?
The InChIKey is VOZQJHGRQLGAOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14ClN5/c1-17-11(13)8(6-15-17)10(16-14)7-4-2-3-5-9(7)12/h2-6,10,16H,13-14H2,1H3.
What are the key properties of 4-[(2-chlorophenyl)-hydrazinylmethyl]-1-methylpyrazol-5-amine?
4-[(2-chlorophenyl)-hydrazinylmethyl]-1-methylpyrazol-5-amine has a molecular weight of 251.72 g/mol, XLogP of 1.21, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-chlorophenyl)-hydrazinylmethyl]-1-methylpyrazol-5-amine is sourced from PubChem (CID 105230692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).