(4-chloro-5-methyl-1H-pyrazol-3-yl)hydrazine

C4H7ClN4 — CID 1380715

IUPAC(4-chloro-5-methyl-1H-pyrazol-3-yl)hydrazine
SMILESCc1[nH]nc(NN)c1Cl
InChIInChI=1S/C4H7ClN4/c1-2-3(5)4(7-6)9-8-2/h6H2,1H3,(H2,7,8,9)
InChIKeyRRQWBOFWEKSPCE-UHFFFAOYSA-N
MW146.58 g/mol
LogP0.66
Rot. Bonds1

About (4-chloro-5-methyl-1H-pyrazol-3-yl)hydrazine

(4-chloro-5-methyl-1H-pyrazol-3-yl)hydrazine (PubChem CID 1380715) has the molecular formula C4H7ClN4 and a molecular weight of 146.58 g/mol. Its IUPAC name is (4-chloro-5-methyl-1H-pyrazol-3-yl)hydrazine.

Molecular Properties

Compound Name(4-chloro-5-methyl-1H-pyrazol-3-yl)hydrazine
PubChem CID1380715
Molecular FormulaC4H7ClN4
Molecular Weight146.58 g/mol
Exact Mass146.04
IUPAC Name(4-chloro-5-methyl-1H-pyrazol-3-yl)hydrazine
SMILESCc1[nH]nc(NN)c1Cl
InChIInChI=1S/C4H7ClN4/c1-2-3(5)4(7-6)9-8-2/h6H2,1H3,(H2,7,8,9)
InChIKeyRRQWBOFWEKSPCE-UHFFFAOYSA-N
XLogP0.66
TPSA66.73 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.58
LogP ≤ 50.66
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (4-chloro-5-methyl-1H-pyrazol-3-yl)hydrazine?
The IUPAC name of (4-chloro-5-methyl-1H-pyrazol-3-yl)hydrazine (CID 1380715) is (4-chloro-5-methyl-1H-pyrazol-3-yl)hydrazine.
What is the SMILES notation for (4-chloro-5-methyl-1H-pyrazol-3-yl)hydrazine?
The canonical SMILES for (4-chloro-5-methyl-1H-pyrazol-3-yl)hydrazine is Cc1[nH]nc(NN)c1Cl.
What is the InChIKey of (4-chloro-5-methyl-1H-pyrazol-3-yl)hydrazine?
The InChIKey is RRQWBOFWEKSPCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H7ClN4/c1-2-3(5)4(7-6)9-8-2/h6H2,1H3,(H2,7,8,9).
What are the key properties of (4-chloro-5-methyl-1H-pyrazol-3-yl)hydrazine?
(4-chloro-5-methyl-1H-pyrazol-3-yl)hydrazine has a molecular weight of 146.58 g/mol, XLogP of 0.66, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-chloro-5-methyl-1H-pyrazol-3-yl)hydrazine is sourced from PubChem (CID 1380715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).