[(5-chloro-1-benzofuran-2-yl)-(5-methyl-3-pyridinyl)methyl]hydrazine

C15H14ClN3O — CID 105338577

IUPAC[(5-chloro-1-benzofuran-2-yl)-(5-methyl-3-pyridinyl)methyl]hydrazine
SMILESCc1cncc(C(NN)c2cc3cc(Cl)ccc3o2)c1
InChIInChI=1S/C15H14ClN3O/c1-9-4-11(8-18-7-9)15(19-17)14-6-10-5-12(16)2-3-13(10)20-14/h2-8,15,19H,17H2,1H3
InChIKeyUVUDLJNJGHSDRX-UHFFFAOYSA-N
MW287.75 g/mol
LogP3.34
Rot. Bonds3

About [(5-chloro-1-benzofuran-2-yl)-(5-methyl-3-pyridinyl)methyl]hydrazine

[(5-chloro-1-benzofuran-2-yl)-(5-methyl-3-pyridinyl)methyl]hydrazine (PubChem CID 105338577) has the molecular formula C15H14ClN3O and a molecular weight of 287.75 g/mol. Its IUPAC name is [(5-chloro-1-benzofuran-2-yl)-(5-methyl-3-pyridinyl)methyl]hydrazine.

Molecular Properties

Compound Name[(5-chloro-1-benzofuran-2-yl)-(5-methyl-3-pyridinyl)methyl]hydrazine
PubChem CID105338577
Molecular FormulaC15H14ClN3O
Molecular Weight287.75 g/mol
Exact Mass287.08
IUPAC Name[(5-chloro-1-benzofuran-2-yl)-(5-methyl-3-pyridinyl)methyl]hydrazine
SMILESCc1cncc(C(NN)c2cc3cc(Cl)ccc3o2)c1
InChIInChI=1S/C15H14ClN3O/c1-9-4-11(8-18-7-9)15(19-17)14-6-10-5-12(16)2-3-13(10)20-14/h2-8,15,19H,17H2,1H3
InChIKeyUVUDLJNJGHSDRX-UHFFFAOYSA-N
XLogP3.34
TPSA64.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.75
LogP ≤ 53.34
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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Related Compounds

N-methyl-1-(5-methyl-1-benzofuran-2-yl)-1-(5-methyl-3-pyridinyl)methanamine
CID 105173880
[(5-chloro-1-benzofuran-2-yl)-(3-chloro-4-methylphenyl)methyl]hydrazine
CID 105338541
[(5-chloro-1-benzofuran-2-yl)-(3,5-difluorophenyl)methyl]hydrazine
CID 105207773
[(3-chlorophenyl)-(5-methyl-1-benzofuran-2-yl)methyl]hydrazine
CID 105194545
[(5-chloro-1-benzofuran-2-yl)-(furan-3-yl)methyl]hydrazine
CID 105221236
[(3-bromo-5-chlorophenyl)-(5-chloro-1-benzofuran-2-yl)methyl]hydrazine
CID 107948526
1-(5-chloro-1-benzofuran-2-yl)-N-methyl-1-(4-methylphenyl)methanamine
CID 114727660
[(5-chloro-1-benzofuran-2-yl)-(3,5-dichloro-2-pyridinyl)methyl]hydrazine
CID 105248605
[(5-chloro-1-benzofuran-2-yl)-(3-methyl-2-pyridinyl)methyl]hydrazine
CID 105209118
[(3,4-dichlorophenyl)-(5-methyl-3-pyridinyl)methyl]hydrazine
CID 105257086
5-chloro-2-[(5-chloro-1-benzofuran-2-yl)-hydrazinylmethyl]aniline
CID 105224051
[(3,5-dimethylphenyl)-(5-fluoro-1-benzofuran-2-yl)methyl]hydrazine
CID 105338687

Frequently Asked Questions

What is the IUPAC name of [(5-chloro-1-benzofuran-2-yl)-(5-methyl-3-pyridinyl)methyl]hydrazine?
The IUPAC name of [(5-chloro-1-benzofuran-2-yl)-(5-methyl-3-pyridinyl)methyl]hydrazine (CID 105338577) is [(5-chloro-1-benzofuran-2-yl)-(5-methyl-3-pyridinyl)methyl]hydrazine.
What is the SMILES notation for [(5-chloro-1-benzofuran-2-yl)-(5-methyl-3-pyridinyl)methyl]hydrazine?
The canonical SMILES for [(5-chloro-1-benzofuran-2-yl)-(5-methyl-3-pyridinyl)methyl]hydrazine is Cc1cncc(C(NN)c2cc3cc(Cl)ccc3o2)c1.
What is the InChIKey of [(5-chloro-1-benzofuran-2-yl)-(5-methyl-3-pyridinyl)methyl]hydrazine?
The InChIKey is UVUDLJNJGHSDRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClN3O/c1-9-4-11(8-18-7-9)15(19-17)14-6-10-5-12(16)2-3-13(10)20-14/h2-8,15,19H,17H2,1H3.
What are the key properties of [(5-chloro-1-benzofuran-2-yl)-(5-methyl-3-pyridinyl)methyl]hydrazine?
[(5-chloro-1-benzofuran-2-yl)-(5-methyl-3-pyridinyl)methyl]hydrazine has a molecular weight of 287.75 g/mol, XLogP of 3.34, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(5-chloro-1-benzofuran-2-yl)-(5-methyl-3-pyridinyl)methyl]hydrazine is sourced from PubChem (CID 105338577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).