4-[2-(4-chloro-1,3-dimethylpyrazol-5-yl)-1-hydrazinylethyl]-1H-pyrazol-5-amine

C10H16ClN7 — CID 105231314

IUPAC4-[2-(4-chloro-1,3-dimethylpyrazol-5-yl)-1-hydrazinylethyl]-1H-pyrazol-5-amine
SMILESCc1nn(C)c(CC(NN)c2cn[nH]c2N)c1Cl
InChIInChI=1S/C10H16ClN7/c1-5-9(11)8(18(2)17-5)3-7(15-13)6-4-14-16-10(6)12/h4,7,15H,3,13H2,1-2H3,(H3,12,14,16)
InChIKeyIRIWCONPFFLFEQ-UHFFFAOYSA-N
MW269.74 g/mol
LogP0.43
Rot. Bonds4

About 4-[2-(4-chloro-1,3-dimethylpyrazol-5-yl)-1-hydrazinylethyl]-1H-pyrazol-5-amine

4-[2-(4-chloro-1,3-dimethylpyrazol-5-yl)-1-hydrazinylethyl]-1H-pyrazol-5-amine (PubChem CID 105231314) has the molecular formula C10H16ClN7 and a molecular weight of 269.74 g/mol. Its IUPAC name is 4-[2-(4-chloro-1,3-dimethylpyrazol-5-yl)-1-hydrazinylethyl]-1H-pyrazol-5-amine.

Molecular Properties

Compound Name4-[2-(4-chloro-1,3-dimethylpyrazol-5-yl)-1-hydrazinylethyl]-1H-pyrazol-5-amine
PubChem CID105231314
Molecular FormulaC10H16ClN7
Molecular Weight269.74 g/mol
Exact Mass269.12
IUPAC Name4-[2-(4-chloro-1,3-dimethylpyrazol-5-yl)-1-hydrazinylethyl]-1H-pyrazol-5-amine
SMILESCc1nn(C)c(CC(NN)c2cn[nH]c2N)c1Cl
InChIInChI=1S/C10H16ClN7/c1-5-9(11)8(18(2)17-5)3-7(15-13)6-4-14-16-10(6)12/h4,7,15H,3,13H2,1-2H3,(H3,12,14,16)
InChIKeyIRIWCONPFFLFEQ-UHFFFAOYSA-N
XLogP0.43
TPSA110.57 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.74
LogP ≤ 50.43
H-Bond Donors ≤ 54
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

[2-(4-chloro-1,3-dimethylpyrazol-5-yl)-1-(5-chloro-2-methylphenyl)ethyl]hydrazine
CID 105316072
[2-(4-chloro-1,3-dimethylpyrazol-5-yl)-1-(5-methylfuran-3-yl)ethyl]hydrazine
CID 105315999
[2-(4-chloro-1,3-dimethylpyrazol-5-yl)-1-(2,5-dimethylpyrazol-3-yl)ethyl]hydrazine
CID 105316011
[2-(4-chloro-1,3-dimethylpyrazol-5-yl)-1-(3,4,5-trifluorophenyl)ethyl]hydrazine
CID 105208217
[2-(4-chloro-1,3-dimethylpyrazol-5-yl)-1-(3-chloro-4-methylphenyl)ethyl]hydrazine
CID 105315986
4-[2-(2-ethyl-5-methylpyrazol-3-yl)-1-hydrazinylethyl]-1H-pyrazol-5-amine
CID 105231039
[2-(4-chloro-1,3-dimethylpyrazol-5-yl)-1-(5-iodothiophen-3-yl)ethyl]hydrazine
CID 105316041
[1-(3-bromothiophen-2-yl)-2-(4-chloro-1,3-dimethylpyrazol-5-yl)ethyl]hydrazine
CID 105316016
[2-(4-chloro-1,3-dimethylpyrazol-5-yl)-1-(3-fluoro-4-methylphenyl)ethyl]hydrazine
CID 105201657
[1-(4-chloro-1,3-dimethylpyrazol-5-yl)-4,4,4-trifluoro-3-(trifluoromethyl)butan-2-yl]hydrazine
CID 103312839
[2-(4-chloro-1,3-dimethylpyrazol-5-yl)-1-(3-methoxythiophen-2-yl)ethyl]hydrazine
CID 105316064
[2-(4-chloro-1,3-dimethylpyrazol-5-yl)-1-(2-fluoro-6-methoxyphenyl)ethyl]hydrazine
CID 105252566

Frequently Asked Questions

What is the IUPAC name of 4-[2-(4-chloro-1,3-dimethylpyrazol-5-yl)-1-hydrazinylethyl]-1H-pyrazol-5-amine?
The IUPAC name of 4-[2-(4-chloro-1,3-dimethylpyrazol-5-yl)-1-hydrazinylethyl]-1H-pyrazol-5-amine (CID 105231314) is 4-[2-(4-chloro-1,3-dimethylpyrazol-5-yl)-1-hydrazinylethyl]-1H-pyrazol-5-amine.
What is the SMILES notation for 4-[2-(4-chloro-1,3-dimethylpyrazol-5-yl)-1-hydrazinylethyl]-1H-pyrazol-5-amine?
The canonical SMILES for 4-[2-(4-chloro-1,3-dimethylpyrazol-5-yl)-1-hydrazinylethyl]-1H-pyrazol-5-amine is Cc1nn(C)c(CC(NN)c2cn[nH]c2N)c1Cl.
What is the InChIKey of 4-[2-(4-chloro-1,3-dimethylpyrazol-5-yl)-1-hydrazinylethyl]-1H-pyrazol-5-amine?
The InChIKey is IRIWCONPFFLFEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16ClN7/c1-5-9(11)8(18(2)17-5)3-7(15-13)6-4-14-16-10(6)12/h4,7,15H,3,13H2,1-2H3,(H3,12,14,16).
What are the key properties of 4-[2-(4-chloro-1,3-dimethylpyrazol-5-yl)-1-hydrazinylethyl]-1H-pyrazol-5-amine?
4-[2-(4-chloro-1,3-dimethylpyrazol-5-yl)-1-hydrazinylethyl]-1H-pyrazol-5-amine has a molecular weight of 269.74 g/mol, XLogP of 0.43, 4 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(4-chloro-1,3-dimethylpyrazol-5-yl)-1-hydrazinylethyl]-1H-pyrazol-5-amine is sourced from PubChem (CID 105231314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).