(3-methylimidazol-4-yl)methylhydrazine;hydrochloride

C5H11ClN4 — CID 46942149

IUPAC(3-methylimidazol-4-yl)methylhydrazine;hydrochloride
SMILESCl.Cn1cncc1CNN
InChIInChI=1S/C5H10N4.ClH/c1-9-4-7-2-5(9)3-8-6;/h2,4,8H,3,6H2,1H3;1H
InChIKeyOSHVDRLBMSLGGI-UHFFFAOYSA-N
MW162.62 g/mol
LogP-0.19
Rot. Bonds2

About (3-methylimidazol-4-yl)methylhydrazine;hydrochloride

(3-methylimidazol-4-yl)methylhydrazine;hydrochloride (PubChem CID 46942149) has the molecular formula C5H11ClN4 and a molecular weight of 162.62 g/mol. Its IUPAC name is (3-methylimidazol-4-yl)methylhydrazine;hydrochloride.

Molecular Properties

Compound Name(3-methylimidazol-4-yl)methylhydrazine;hydrochloride
PubChem CID46942149
Molecular FormulaC5H11ClN4
Molecular Weight162.62 g/mol
Exact Mass162.07
IUPAC Name(3-methylimidazol-4-yl)methylhydrazine;hydrochloride
SMILESCl.Cn1cncc1CNN
InChIInChI=1S/C5H10N4.ClH/c1-9-4-7-2-5(9)3-8-6;/h2,4,8H,3,6H2,1H3;1H
InChIKeyOSHVDRLBMSLGGI-UHFFFAOYSA-N
XLogP-0.19
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.62
LogP ≤ 5-0.19
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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Frequently Asked Questions

What is the IUPAC name of (3-methylimidazol-4-yl)methylhydrazine;hydrochloride?
The IUPAC name of (3-methylimidazol-4-yl)methylhydrazine;hydrochloride (CID 46942149) is (3-methylimidazol-4-yl)methylhydrazine;hydrochloride.
What is the SMILES notation for (3-methylimidazol-4-yl)methylhydrazine;hydrochloride?
The canonical SMILES for (3-methylimidazol-4-yl)methylhydrazine;hydrochloride is Cl.Cn1cncc1CNN.
What is the InChIKey of (3-methylimidazol-4-yl)methylhydrazine;hydrochloride?
The InChIKey is OSHVDRLBMSLGGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N4.ClH/c1-9-4-7-2-5(9)3-8-6;/h2,4,8H,3,6H2,1H3;1H.
What are the key properties of (3-methylimidazol-4-yl)methylhydrazine;hydrochloride?
(3-methylimidazol-4-yl)methylhydrazine;hydrochloride has a molecular weight of 162.62 g/mol, XLogP of -0.19, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3-methylimidazol-4-yl)methylhydrazine;hydrochloride is sourced from PubChem (CID 46942149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).