(4-chloro-1H-pyrazol-5-yl)hydrazine;hydrochloride

C3H6Cl2N4 — CID 70470994

IUPAC(4-chloro-1H-pyrazol-5-yl)hydrazine;hydrochloride
SMILESCl.NNc1[nH]ncc1Cl
InChIInChI=1S/C3H5ClN4.ClH/c4-2-1-6-8-3(2)7-5;/h1H,5H2,(H2,6,7,8);1H
InChIKeyYFHJSVYGVFQBDQ-UHFFFAOYSA-N
MW169.01 g/mol
LogP0.77
Rot. Bonds1

About (4-chloro-1H-pyrazol-5-yl)hydrazine;hydrochloride

(4-chloro-1H-pyrazol-5-yl)hydrazine;hydrochloride (PubChem CID 70470994) has the molecular formula C3H6Cl2N4 and a molecular weight of 169.01 g/mol. Its IUPAC name is (4-chloro-1H-pyrazol-5-yl)hydrazine;hydrochloride.

Molecular Properties

Compound Name(4-chloro-1H-pyrazol-5-yl)hydrazine;hydrochloride
PubChem CID70470994
Molecular FormulaC3H6Cl2N4
Molecular Weight169.01 g/mol
Exact Mass168.00
IUPAC Name(4-chloro-1H-pyrazol-5-yl)hydrazine;hydrochloride
SMILESCl.NNc1[nH]ncc1Cl
InChIInChI=1S/C3H5ClN4.ClH/c4-2-1-6-8-3(2)7-5;/h1H,5H2,(H2,6,7,8);1H
InChIKeyYFHJSVYGVFQBDQ-UHFFFAOYSA-N
XLogP0.77
TPSA66.73 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.01
LogP ≤ 50.77
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-1H-pyrazol-5-yl)hydrazine;hydrochloride?
The IUPAC name of (4-chloro-1H-pyrazol-5-yl)hydrazine;hydrochloride (CID 70470994) is (4-chloro-1H-pyrazol-5-yl)hydrazine;hydrochloride.
What is the SMILES notation for (4-chloro-1H-pyrazol-5-yl)hydrazine;hydrochloride?
The canonical SMILES for (4-chloro-1H-pyrazol-5-yl)hydrazine;hydrochloride is Cl.NNc1[nH]ncc1Cl.
What is the InChIKey of (4-chloro-1H-pyrazol-5-yl)hydrazine;hydrochloride?
The InChIKey is YFHJSVYGVFQBDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H5ClN4.ClH/c4-2-1-6-8-3(2)7-5;/h1H,5H2,(H2,6,7,8);1H.
What are the key properties of (4-chloro-1H-pyrazol-5-yl)hydrazine;hydrochloride?
(4-chloro-1H-pyrazol-5-yl)hydrazine;hydrochloride has a molecular weight of 169.01 g/mol, XLogP of 0.77, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-chloro-1H-pyrazol-5-yl)hydrazine;hydrochloride is sourced from PubChem (CID 70470994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).