[(5-methylfuran-2-yl)-(2-methylquinolin-6-yl)methyl]hydrazine

C16H17N3O — CID 105327229

IUPAC[(5-methylfuran-2-yl)-(2-methylquinolin-6-yl)methyl]hydrazine
SMILESCc1ccc2cc(C(NN)c3ccc(C)o3)ccc2n1
InChIInChI=1S/C16H17N3O/c1-10-3-5-12-9-13(6-7-14(12)18-10)16(19-17)15-8-4-11(2)20-15/h3-9,16,19H,17H2,1-2H3
InChIKeyCHNFUWKLAJIFKV-UHFFFAOYSA-N
MW267.33 g/mol
LogP3.00
Rot. Bonds3

About [(5-methylfuran-2-yl)-(2-methylquinolin-6-yl)methyl]hydrazine

[(5-methylfuran-2-yl)-(2-methylquinolin-6-yl)methyl]hydrazine (PubChem CID 105327229) has the molecular formula C16H17N3O and a molecular weight of 267.33 g/mol. Its IUPAC name is [(5-methylfuran-2-yl)-(2-methylquinolin-6-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(5-methylfuran-2-yl)-(2-methylquinolin-6-yl)methyl]hydrazine
PubChem CID105327229
Molecular FormulaC16H17N3O
Molecular Weight267.33 g/mol
Exact Mass267.14
IUPAC Name[(5-methylfuran-2-yl)-(2-methylquinolin-6-yl)methyl]hydrazine
SMILESCc1ccc2cc(C(NN)c3ccc(C)o3)ccc2n1
InChIInChI=1S/C16H17N3O/c1-10-3-5-12-9-13(6-7-14(12)18-10)16(19-17)15-8-4-11(2)20-15/h3-9,16,19H,17H2,1-2H3
InChIKeyCHNFUWKLAJIFKV-UHFFFAOYSA-N
XLogP3.00
TPSA64.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.33
LogP ≤ 53.00
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 [(5-methylfuran-2-yl)-(2-methylquinolin-6-yl)methyl]hydrazine?
The IUPAC name of [(5-methylfuran-2-yl)-(2-methylquinolin-6-yl)methyl]hydrazine (CID 105327229) is [(5-methylfuran-2-yl)-(2-methylquinolin-6-yl)methyl]hydrazine.
What is the SMILES notation for [(5-methylfuran-2-yl)-(2-methylquinolin-6-yl)methyl]hydrazine?
The canonical SMILES for [(5-methylfuran-2-yl)-(2-methylquinolin-6-yl)methyl]hydrazine is Cc1ccc2cc(C(NN)c3ccc(C)o3)ccc2n1.
What is the InChIKey of [(5-methylfuran-2-yl)-(2-methylquinolin-6-yl)methyl]hydrazine?
The InChIKey is CHNFUWKLAJIFKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O/c1-10-3-5-12-9-13(6-7-14(12)18-10)16(19-17)15-8-4-11(2)20-15/h3-9,16,19H,17H2,1-2H3.
What are the key properties of [(5-methylfuran-2-yl)-(2-methylquinolin-6-yl)methyl]hydrazine?
[(5-methylfuran-2-yl)-(2-methylquinolin-6-yl)methyl]hydrazine has a molecular weight of 267.33 g/mol, XLogP of 3.00, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(5-methylfuran-2-yl)-(2-methylquinolin-6-yl)methyl]hydrazine is sourced from PubChem (CID 105327229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).