[(7-methyl-1-benzofuran-2-yl)-(1-methylimidazol-4-yl)methyl]hydrazine

C14H16N4O — CID 114023468

IUPAC[(7-methyl-1-benzofuran-2-yl)-(1-methylimidazol-4-yl)methyl]hydrazine
SMILESCc1cccc2cc(C(NN)c3cn(C)cn3)oc12
InChIInChI=1S/C14H16N4O/c1-9-4-3-5-10-6-12(19-14(9)10)13(17-15)11-7-18(2)8-16-11/h3-8,13,17H,15H2,1-2H3
InChIKeyDNQPRPMLBXJPMZ-UHFFFAOYSA-N
MW256.31 g/mol
LogP2.03
Rot. Bonds3

About [(7-methyl-1-benzofuran-2-yl)-(1-methylimidazol-4-yl)methyl]hydrazine

[(7-methyl-1-benzofuran-2-yl)-(1-methylimidazol-4-yl)methyl]hydrazine (PubChem CID 114023468) has the molecular formula C14H16N4O and a molecular weight of 256.31 g/mol. Its IUPAC name is [(7-methyl-1-benzofuran-2-yl)-(1-methylimidazol-4-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(7-methyl-1-benzofuran-2-yl)-(1-methylimidazol-4-yl)methyl]hydrazine
PubChem CID114023468
Molecular FormulaC14H16N4O
Molecular Weight256.31 g/mol
Exact Mass256.13
IUPAC Name[(7-methyl-1-benzofuran-2-yl)-(1-methylimidazol-4-yl)methyl]hydrazine
SMILESCc1cccc2cc(C(NN)c3cn(C)cn3)oc12
InChIInChI=1S/C14H16N4O/c1-9-4-3-5-10-6-12(19-14(9)10)13(17-15)11-7-18(2)8-16-11/h3-8,13,17H,15H2,1-2H3
InChIKeyDNQPRPMLBXJPMZ-UHFFFAOYSA-N
XLogP2.03
TPSA69.01 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.31
LogP ≤ 52.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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

[1-benzofuran-2-yl-(1-methylimidazol-4-yl)methyl]hydrazine
CID 107979425
[(6-methoxypyridazin-3-yl)-(7-methyl-1-benzofuran-2-yl)methyl]hydrazine
CID 103375494
[(7-methyl-1-benzofuran-2-yl)-(thiadiazol-4-yl)methyl]hydrazine
CID 105338371
[(7-methyl-1-benzofuran-2-yl)-pyridin-4-ylmethyl]hydrazine
CID 105196376
N-[(7-chloro-1-benzofuran-2-yl)-(1-methylimidazol-4-yl)methyl]propan-1-amine
CID 107977704
[(7-methyl-1-benzofuran-2-yl)-(2-methylfuran-3-yl)methyl]hydrazine
CID 105268934
[(3,5-dichloro-2-pyridinyl)-(7-methyl-1-benzofuran-2-yl)methyl]hydrazine
CID 105248604
[(1-methylimidazol-4-yl)-(2,4,5-trimethylphenyl)methyl]hydrazine
CID 107979173
[(4-bromo-3-methylphenyl)-(7-methyl-1-benzofuran-2-yl)methyl]hydrazine
CID 105338351
[1-benzothiophen-7-yl-(1-methylimidazol-4-yl)methyl]hydrazine
CID 107979326
[(3-ethylthiophen-2-yl)-(7-methyl-1-benzofuran-2-yl)methyl]hydrazine
CID 105338360
[(3,4-difluorophenyl)-(1-methylimidazol-4-yl)methyl]hydrazine
CID 107979097

Frequently Asked Questions

What is the IUPAC name of [(7-methyl-1-benzofuran-2-yl)-(1-methylimidazol-4-yl)methyl]hydrazine?
The IUPAC name of [(7-methyl-1-benzofuran-2-yl)-(1-methylimidazol-4-yl)methyl]hydrazine (CID 114023468) is [(7-methyl-1-benzofuran-2-yl)-(1-methylimidazol-4-yl)methyl]hydrazine.
What is the SMILES notation for [(7-methyl-1-benzofuran-2-yl)-(1-methylimidazol-4-yl)methyl]hydrazine?
The canonical SMILES for [(7-methyl-1-benzofuran-2-yl)-(1-methylimidazol-4-yl)methyl]hydrazine is Cc1cccc2cc(C(NN)c3cn(C)cn3)oc12.
What is the InChIKey of [(7-methyl-1-benzofuran-2-yl)-(1-methylimidazol-4-yl)methyl]hydrazine?
The InChIKey is DNQPRPMLBXJPMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4O/c1-9-4-3-5-10-6-12(19-14(9)10)13(17-15)11-7-18(2)8-16-11/h3-8,13,17H,15H2,1-2H3.
What are the key properties of [(7-methyl-1-benzofuran-2-yl)-(1-methylimidazol-4-yl)methyl]hydrazine?
[(7-methyl-1-benzofuran-2-yl)-(1-methylimidazol-4-yl)methyl]hydrazine has a molecular weight of 256.31 g/mol, XLogP of 2.03, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [(7-methyl-1-benzofuran-2-yl)-(1-methylimidazol-4-yl)methyl]hydrazine is sourced from PubChem (CID 114023468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).