N'-(1-benzofuran-2-carbonyl)-2-(furan-2-yl)quinoline-4-carbohydrazide

C23H15N3O4 — CID 2469170

IUPACN'-(1-benzofuran-2-carbonyl)-2-(furan-2-yl)quinoline-4-carbohydrazide
SMILESO=C(NNC(=O)c1cc(-c2ccco2)nc2ccccc12)c1cc2ccccc2o1
InChIInChI=1S/C23H15N3O4/c27-22(25-26-23(28)21-12-14-6-1-4-9-19(14)30-21)16-13-18(20-10-5-11-29-20)24-17-8-3-2-7-15(16)17/h1-13H,(H,25,27)(H,26,28)
InChIKeySBQFKHJHFWKDEC-UHFFFAOYSA-N
MW397.39 g/mol
LogP4.32
Rot. Bonds3

About N'-(1-benzofuran-2-carbonyl)-2-(furan-2-yl)quinoline-4-carbohydrazide

N'-(1-benzofuran-2-carbonyl)-2-(furan-2-yl)quinoline-4-carbohydrazide (PubChem CID 2469170) has the molecular formula C23H15N3O4 and a molecular weight of 397.39 g/mol. Its IUPAC name is N'-(1-benzofuran-2-carbonyl)-2-(furan-2-yl)quinoline-4-carbohydrazide.

Molecular Properties

Compound NameN'-(1-benzofuran-2-carbonyl)-2-(furan-2-yl)quinoline-4-carbohydrazide
PubChem CID2469170
Molecular FormulaC23H15N3O4
Molecular Weight397.39 g/mol
Exact Mass397.11
IUPAC NameN'-(1-benzofuran-2-carbonyl)-2-(furan-2-yl)quinoline-4-carbohydrazide
SMILESO=C(NNC(=O)c1cc(-c2ccco2)nc2ccccc12)c1cc2ccccc2o1
InChIInChI=1S/C23H15N3O4/c27-22(25-26-23(28)21-12-14-6-1-4-9-19(14)30-21)16-13-18(20-10-5-11-29-20)24-17-8-3-2-7-15(16)17/h1-13H,(H,25,27)(H,26,28)
InChIKeySBQFKHJHFWKDEC-UHFFFAOYSA-N
XLogP4.32
TPSA97.37 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500397.39
LogP ≤ 54.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-[4-[2-[2-[2-(furan-2-yl)quinoline-4-carbonyl]hydrazinyl]-2-oxoethyl]phenyl]acetamide
CID 134029227
N-tert-butyl-2-(furan-2-yl)quinoline-4-carboxamide
CID 3611196
2-(furan-2-yl)-N'-(2-oxo-6-phenyl-1H-pyridine-3-carbonyl)quinoline-4-carbohydrazide
CID 55789537
2-(furan-2-yl)-N-[(1R)-1-phenylethyl]quinoline-4-carboxamide
CID 903434
N-[(2S)-1-(benzylamino)-1-oxopropan-2-yl]-2-(furan-2-yl)quinoline-4-carboxamide
CID 52505811
N-[(2R)-1-(benzylamino)-1-oxopropan-2-yl]-2-(furan-2-yl)quinoline-4-carboxamide
CID 52505812
N-[1-[2-[2-(furan-2-yl)quinoline-4-carbonyl]hydrazinyl]-1-oxopropan-2-yl]benzenesulfonamide
CID 55350263
N-butan-2-yl-2-(furan-2-yl)quinoline-4-carboxamide
CID 3637493
2-(furan-2-yl)-N-[4-[4-[[2-(furan-2-yl)quinoline-4-carbonyl]amino]phenoxy]phenyl]quinoline-4-carboxamide
CID 3663828
2-(furan-2-yl)-N-(2-hydroxypropyl)quinoline-4-carboxamide
CID 78800391
methyl (2R)-2-[[2-(furan-2-yl)quinoline-4-carbonyl]amino]-2-phenylacetate
CID 69058488
N-[2-(3-chlorophenyl)ethyl]-2-(furan-2-yl)quinoline-4-carboxamide
CID 4124660

Frequently Asked Questions

What is the IUPAC name of N'-(1-benzofuran-2-carbonyl)-2-(furan-2-yl)quinoline-4-carbohydrazide?
The IUPAC name of N'-(1-benzofuran-2-carbonyl)-2-(furan-2-yl)quinoline-4-carbohydrazide (CID 2469170) is N'-(1-benzofuran-2-carbonyl)-2-(furan-2-yl)quinoline-4-carbohydrazide.
What is the SMILES notation for N'-(1-benzofuran-2-carbonyl)-2-(furan-2-yl)quinoline-4-carbohydrazide?
The canonical SMILES for N'-(1-benzofuran-2-carbonyl)-2-(furan-2-yl)quinoline-4-carbohydrazide is O=C(NNC(=O)c1cc(-c2ccco2)nc2ccccc12)c1cc2ccccc2o1.
What is the InChIKey of N'-(1-benzofuran-2-carbonyl)-2-(furan-2-yl)quinoline-4-carbohydrazide?
The InChIKey is SBQFKHJHFWKDEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H15N3O4/c27-22(25-26-23(28)21-12-14-6-1-4-9-19(14)30-21)16-13-18(20-10-5-11-29-20)24-17-8-3-2-7-15(16)17/h1-13H,(H,25,27)(H,26,28).
What are the key properties of N'-(1-benzofuran-2-carbonyl)-2-(furan-2-yl)quinoline-4-carbohydrazide?
N'-(1-benzofuran-2-carbonyl)-2-(furan-2-yl)quinoline-4-carbohydrazide has a molecular weight of 397.39 g/mol, XLogP of 4.32, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(1-benzofuran-2-carbonyl)-2-(furan-2-yl)quinoline-4-carbohydrazide is sourced from PubChem (CID 2469170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).