N'-(4-ethylbenzoyl)-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carbohydrazide

C20H19N3O4 — CID 134024433

IUPACN'-(4-ethylbenzoyl)-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carbohydrazide
SMILESCCc1ccc(C(=O)NNC(=O)c2ccc(Cn3ccccc3=O)o2)cc1
InChIInChI=1S/C20H19N3O4/c1-2-14-6-8-15(9-7-14)19(25)21-22-20(26)17-11-10-16(27-17)13-23-12-4-3-5-18(23)24/h3-12H,2,13H2,1H3,(H,21,25)(H,22,26)
InChIKeyCCFSLCBVBOKBIF-UHFFFAOYSA-N
MW365.39 g/mol
LogP2.13
Rot. Bonds5

About N'-(4-ethylbenzoyl)-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carbohydrazide

N'-(4-ethylbenzoyl)-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carbohydrazide (PubChem CID 134024433) has the molecular formula C20H19N3O4 and a molecular weight of 365.39 g/mol. Its IUPAC name is N'-(4-ethylbenzoyl)-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carbohydrazide.

Molecular Properties

Compound NameN'-(4-ethylbenzoyl)-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carbohydrazide
PubChem CID134024433
Molecular FormulaC20H19N3O4
Molecular Weight365.39 g/mol
Exact Mass365.14
IUPAC NameN'-(4-ethylbenzoyl)-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carbohydrazide
SMILESCCc1ccc(C(=O)NNC(=O)c2ccc(Cn3ccccc3=O)o2)cc1
InChIInChI=1S/C20H19N3O4/c1-2-14-6-8-15(9-7-14)19(25)21-22-20(26)17-11-10-16(27-17)13-23-12-4-3-5-18(23)24/h3-12H,2,13H2,1H3,(H,21,25)(H,22,26)
InChIKeyCCFSLCBVBOKBIF-UHFFFAOYSA-N
XLogP2.13
TPSA93.34 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.39
LogP ≤ 52.13
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

4-ethyl-N'-[2-(2-oxo-1-pyridinyl)acetyl]benzohydrazide
CID 78791798
N-[(2R)-3-methylbutan-2-yl]-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide
CID 30597946
N-[(2S)-3-methylbutan-2-yl]-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide
CID 30597949
N-(2-methylpropyl)-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide
CID 47141529
N-(4-tert-butylphenyl)-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide
CID 134024272
N'-[(2R)-2-(4-ethoxyphenoxy)propanoyl]-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carbohydrazide
CID 32805465
N-[2-(2-methylpropanoylamino)ethyl]-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide
CID 31344363
N-[2-[[(2S)-butan-2-yl]carbamoyl]phenyl]-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide
CID 31518398
5-[(2-oxo-1-pyridinyl)methyl]-N-prop-2-enylfuran-2-carboxamide
CID 47141528
N-(4-ethylsulfonylphenyl)-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide
CID 39863132
N'-[2-(2,4-dimethylanilino)acetyl]-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carbohydrazide
CID 134038858
N-[(2R)-1-ethoxy-3-methylbutan-2-yl]-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide
CID 124851092

Frequently Asked Questions

What is the IUPAC name of N'-(4-ethylbenzoyl)-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carbohydrazide?
The IUPAC name of N'-(4-ethylbenzoyl)-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carbohydrazide (CID 134024433) is N'-(4-ethylbenzoyl)-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carbohydrazide.
What is the SMILES notation for N'-(4-ethylbenzoyl)-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carbohydrazide?
The canonical SMILES for N'-(4-ethylbenzoyl)-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carbohydrazide is CCc1ccc(C(=O)NNC(=O)c2ccc(Cn3ccccc3=O)o2)cc1.
What is the InChIKey of N'-(4-ethylbenzoyl)-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carbohydrazide?
The InChIKey is CCFSLCBVBOKBIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3O4/c1-2-14-6-8-15(9-7-14)19(25)21-22-20(26)17-11-10-16(27-17)13-23-12-4-3-5-18(23)24/h3-12H,2,13H2,1H3,(H,21,25)(H,22,26).
What are the key properties of N'-(4-ethylbenzoyl)-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carbohydrazide?
N'-(4-ethylbenzoyl)-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carbohydrazide has a molecular weight of 365.39 g/mol, XLogP of 2.13, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(4-ethylbenzoyl)-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carbohydrazide is sourced from PubChem (CID 134024433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).