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

C16H16N2O — CID 105269167

IUPAC[(2-methylfuran-3-yl)-naphthalen-1-ylmethyl]hydrazine
SMILESCc1occc1C(NN)c1cccc2ccccc12
InChIInChI=1S/C16H16N2O/c1-11-13(9-10-19-11)16(18-17)15-8-4-6-12-5-2-3-7-14(12)15/h2-10,16,18H,17H2,1H3
InChIKeyLYTOJIXNCANENQ-UHFFFAOYSA-N
MW252.32 g/mol
LogP3.29
Rot. Bonds3

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

[(2-methylfuran-3-yl)-naphthalen-1-ylmethyl]hydrazine (PubChem CID 105269167) has the molecular formula C16H16N2O and a molecular weight of 252.32 g/mol. Its IUPAC name is [(2-methylfuran-3-yl)-naphthalen-1-ylmethyl]hydrazine.

Molecular Properties

Compound Name[(2-methylfuran-3-yl)-naphthalen-1-ylmethyl]hydrazine
PubChem CID105269167
Molecular FormulaC16H16N2O
Molecular Weight252.32 g/mol
Exact Mass252.13
IUPAC Name[(2-methylfuran-3-yl)-naphthalen-1-ylmethyl]hydrazine
SMILESCc1occc1C(NN)c1cccc2ccccc12
InChIInChI=1S/C16H16N2O/c1-11-13(9-10-19-11)16(18-17)15-8-4-6-12-5-2-3-7-14(12)15/h2-10,16,18H,17H2,1H3
InChIKeyLYTOJIXNCANENQ-UHFFFAOYSA-N
XLogP3.29
TPSA51.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.32
LogP ≤ 53.29
H-Bond Donors ≤ 52
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 [(2-methylfuran-3-yl)-naphthalen-1-ylmethyl]hydrazine?
The IUPAC name of [(2-methylfuran-3-yl)-naphthalen-1-ylmethyl]hydrazine (CID 105269167) is [(2-methylfuran-3-yl)-naphthalen-1-ylmethyl]hydrazine.
What is the SMILES notation for [(2-methylfuran-3-yl)-naphthalen-1-ylmethyl]hydrazine?
The canonical SMILES for [(2-methylfuran-3-yl)-naphthalen-1-ylmethyl]hydrazine is Cc1occc1C(NN)c1cccc2ccccc12.
What is the InChIKey of [(2-methylfuran-3-yl)-naphthalen-1-ylmethyl]hydrazine?
The InChIKey is LYTOJIXNCANENQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2O/c1-11-13(9-10-19-11)16(18-17)15-8-4-6-12-5-2-3-7-14(12)15/h2-10,16,18H,17H2,1H3.
What are the key properties of [(2-methylfuran-3-yl)-naphthalen-1-ylmethyl]hydrazine?
[(2-methylfuran-3-yl)-naphthalen-1-ylmethyl]hydrazine has a molecular weight of 252.32 g/mol, XLogP of 3.29, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(2-methylfuran-3-yl)-naphthalen-1-ylmethyl]hydrazine is sourced from PubChem (CID 105269167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).