[(2-methylpyrazol-3-yl)-naphthalen-1-ylmethyl]hydrazine

C15H16N4 — CID 105213181

IUPAC[(2-methylpyrazol-3-yl)-naphthalen-1-ylmethyl]hydrazine
SMILESCn1nccc1C(NN)c1cccc2ccccc12
InChIInChI=1S/C15H16N4/c1-19-14(9-10-17-19)15(18-16)13-8-4-6-11-5-2-3-7-12(11)13/h2-10,15,18H,16H2,1H3
InChIKeyCKLJLFHFFKOXNE-UHFFFAOYSA-N
MW252.32 g/mol
LogP2.13
Rot. Bonds3

About [(2-methylpyrazol-3-yl)-naphthalen-1-ylmethyl]hydrazine

[(2-methylpyrazol-3-yl)-naphthalen-1-ylmethyl]hydrazine (PubChem CID 105213181) has the molecular formula C15H16N4 and a molecular weight of 252.32 g/mol. Its IUPAC name is [(2-methylpyrazol-3-yl)-naphthalen-1-ylmethyl]hydrazine.

Molecular Properties

Compound Name[(2-methylpyrazol-3-yl)-naphthalen-1-ylmethyl]hydrazine
PubChem CID105213181
Molecular FormulaC15H16N4
Molecular Weight252.32 g/mol
Exact Mass252.14
IUPAC Name[(2-methylpyrazol-3-yl)-naphthalen-1-ylmethyl]hydrazine
SMILESCn1nccc1C(NN)c1cccc2ccccc12
InChIInChI=1S/C15H16N4/c1-19-14(9-10-17-19)15(18-16)13-8-4-6-11-5-2-3-7-12(11)13/h2-10,15,18H,16H2,1H3
InChIKeyCKLJLFHFFKOXNE-UHFFFAOYSA-N
XLogP2.13
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.32
LogP ≤ 52.13
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 [(2-methylpyrazol-3-yl)-naphthalen-1-ylmethyl]hydrazine?
The IUPAC name of [(2-methylpyrazol-3-yl)-naphthalen-1-ylmethyl]hydrazine (CID 105213181) is [(2-methylpyrazol-3-yl)-naphthalen-1-ylmethyl]hydrazine.
What is the SMILES notation for [(2-methylpyrazol-3-yl)-naphthalen-1-ylmethyl]hydrazine?
The canonical SMILES for [(2-methylpyrazol-3-yl)-naphthalen-1-ylmethyl]hydrazine is Cn1nccc1C(NN)c1cccc2ccccc12.
What is the InChIKey of [(2-methylpyrazol-3-yl)-naphthalen-1-ylmethyl]hydrazine?
The InChIKey is CKLJLFHFFKOXNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4/c1-19-14(9-10-17-19)15(18-16)13-8-4-6-11-5-2-3-7-12(11)13/h2-10,15,18H,16H2,1H3.
What are the key properties of [(2-methylpyrazol-3-yl)-naphthalen-1-ylmethyl]hydrazine?
[(2-methylpyrazol-3-yl)-naphthalen-1-ylmethyl]hydrazine has a molecular weight of 252.32 g/mol, XLogP of 2.13, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(2-methylpyrazol-3-yl)-naphthalen-1-ylmethyl]hydrazine is sourced from PubChem (CID 105213181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).