1-benzyl-1-[2-(quinolin-2-ylmethoxy)phenyl]hydrazine

C23H21N3O — CID 19814666

IUPAC1-benzyl-1-[2-(quinolin-2-ylmethoxy)phenyl]hydrazine
SMILESNN(Cc1ccccc1)c1ccccc1OCc1ccc2ccccc2n1
InChIInChI=1S/C23H21N3O/c24-26(16-18-8-2-1-3-9-18)22-12-6-7-13-23(22)27-17-20-15-14-19-10-4-5-11-21(19)25-20/h1-15H,16-17,24H2
InChIKeyHDUSOCWRDITTDN-UHFFFAOYSA-N
MW355.44 g/mol
LogP4.69
Rot. Bonds6

About 1-benzyl-1-[2-(quinolin-2-ylmethoxy)phenyl]hydrazine

1-benzyl-1-[2-(quinolin-2-ylmethoxy)phenyl]hydrazine (PubChem CID 19814666) has the molecular formula C23H21N3O and a molecular weight of 355.44 g/mol. Its IUPAC name is 1-benzyl-1-[2-(quinolin-2-ylmethoxy)phenyl]hydrazine.

Molecular Properties

Compound Name1-benzyl-1-[2-(quinolin-2-ylmethoxy)phenyl]hydrazine
PubChem CID19814666
Molecular FormulaC23H21N3O
Molecular Weight355.44 g/mol
Exact Mass355.17
IUPAC Name1-benzyl-1-[2-(quinolin-2-ylmethoxy)phenyl]hydrazine
SMILESNN(Cc1ccccc1)c1ccccc1OCc1ccc2ccccc2n1
InChIInChI=1S/C23H21N3O/c24-26(16-18-8-2-1-3-9-18)22-12-6-7-13-23(22)27-17-20-15-14-19-10-4-5-11-21(19)25-20/h1-15H,16-17,24H2
InChIKeyHDUSOCWRDITTDN-UHFFFAOYSA-N
XLogP4.69
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.44
LogP ≤ 54.69
H-Bond Donors ≤ 51
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 1-benzyl-1-[2-(quinolin-2-ylmethoxy)phenyl]hydrazine?
The IUPAC name of 1-benzyl-1-[2-(quinolin-2-ylmethoxy)phenyl]hydrazine (CID 19814666) is 1-benzyl-1-[2-(quinolin-2-ylmethoxy)phenyl]hydrazine.
What is the SMILES notation for 1-benzyl-1-[2-(quinolin-2-ylmethoxy)phenyl]hydrazine?
The canonical SMILES for 1-benzyl-1-[2-(quinolin-2-ylmethoxy)phenyl]hydrazine is NN(Cc1ccccc1)c1ccccc1OCc1ccc2ccccc2n1.
What is the InChIKey of 1-benzyl-1-[2-(quinolin-2-ylmethoxy)phenyl]hydrazine?
The InChIKey is HDUSOCWRDITTDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21N3O/c24-26(16-18-8-2-1-3-9-18)22-12-6-7-13-23(22)27-17-20-15-14-19-10-4-5-11-21(19)25-20/h1-15H,16-17,24H2.
What are the key properties of 1-benzyl-1-[2-(quinolin-2-ylmethoxy)phenyl]hydrazine?
1-benzyl-1-[2-(quinolin-2-ylmethoxy)phenyl]hydrazine has a molecular weight of 355.44 g/mol, XLogP of 4.69, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-1-[2-(quinolin-2-ylmethoxy)phenyl]hydrazine is sourced from PubChem (CID 19814666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).