N'-(4-ethylbenzoyl)oxolane-2-carbohydrazide

C14H18N2O3 — CID 47099547

IUPACN'-(4-ethylbenzoyl)oxolane-2-carbohydrazide
SMILESCCc1ccc(C(=O)NNC(=O)C2CCCO2)cc1
InChIInChI=1S/C14H18N2O3/c1-2-10-5-7-11(8-6-10)13(17)15-16-14(18)12-4-3-9-19-12/h5-8,12H,2-4,9H2,1H3,(H,15,17)(H,16,18)
InChIKeyQOPCRIURRANUES-UHFFFAOYSA-N
MW262.31 g/mol
LogP1.19
Rot. Bonds3

About N'-(4-ethylbenzoyl)oxolane-2-carbohydrazide

N'-(4-ethylbenzoyl)oxolane-2-carbohydrazide (PubChem CID 47099547) has the molecular formula C14H18N2O3 and a molecular weight of 262.31 g/mol. Its IUPAC name is N'-(4-ethylbenzoyl)oxolane-2-carbohydrazide.

Molecular Properties

Compound NameN'-(4-ethylbenzoyl)oxolane-2-carbohydrazide
PubChem CID47099547
Molecular FormulaC14H18N2O3
Molecular Weight262.31 g/mol
Exact Mass262.13
IUPAC NameN'-(4-ethylbenzoyl)oxolane-2-carbohydrazide
SMILESCCc1ccc(C(=O)NNC(=O)C2CCCO2)cc1
InChIInChI=1S/C14H18N2O3/c1-2-10-5-7-11(8-6-10)13(17)15-16-14(18)12-4-3-9-19-12/h5-8,12H,2-4,9H2,1H3,(H,15,17)(H,16,18)
InChIKeyQOPCRIURRANUES-UHFFFAOYSA-N
XLogP1.19
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.31
LogP ≤ 51.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(2S)-N'-(4-methylbenzoyl)oxolane-2-carbohydrazide
CID 40870131
N-[(4-ethylphenyl)methyl]oxolane-2-carboxamide
CID 110779522
(2S)-N'-(3,4-diethoxybenzoyl)oxolane-2-carbohydrazide
CID 912755
N-[1-(4-ethylphenyl)-2-methylpropyl]oxolane-2-carboxamide
CID 78810784
N-[[4-(methylcarbamoyl)phenyl]methyl]oxolane-2-carboxamide
CID 47160865
(2S)-N'-(3-fluorobenzoyl)oxolane-2-carbohydrazide
CID 772334
N'-(3-methylbenzoyl)oxolane-2-carbohydrazide
CID 3128422
(2R)-N'-(3-methylbenzoyl)oxolane-2-carbohydrazide
CID 7406384
N'-[4-(1H-benzimidazol-2-ylsulfanylmethyl)benzoyl]oxolane-2-carbohydrazide
CID 42905169
4-ethoxy-N-[4-[(oxolane-2-carbonylamino)carbamoyl]phenyl]benzenesulfonamide
CID 43002871
N'-(4-ethylbenzoyl)-2,3-dihydro-1,4-benzodioxine-3-carbohydrazide
CID 42889119
N'-[2-(4-chlorophenyl)acetyl]oxolane-2-carbohydrazide
CID 5343509

Frequently Asked Questions

What is the IUPAC name of N'-(4-ethylbenzoyl)oxolane-2-carbohydrazide?
The IUPAC name of N'-(4-ethylbenzoyl)oxolane-2-carbohydrazide (CID 47099547) is N'-(4-ethylbenzoyl)oxolane-2-carbohydrazide.
What is the SMILES notation for N'-(4-ethylbenzoyl)oxolane-2-carbohydrazide?
The canonical SMILES for N'-(4-ethylbenzoyl)oxolane-2-carbohydrazide is CCc1ccc(C(=O)NNC(=O)C2CCCO2)cc1.
What is the InChIKey of N'-(4-ethylbenzoyl)oxolane-2-carbohydrazide?
The InChIKey is QOPCRIURRANUES-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O3/c1-2-10-5-7-11(8-6-10)13(17)15-16-14(18)12-4-3-9-19-12/h5-8,12H,2-4,9H2,1H3,(H,15,17)(H,16,18).
What are the key properties of N'-(4-ethylbenzoyl)oxolane-2-carbohydrazide?
N'-(4-ethylbenzoyl)oxolane-2-carbohydrazide has a molecular weight of 262.31 g/mol, XLogP of 1.19, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(4-ethylbenzoyl)oxolane-2-carbohydrazide is sourced from PubChem (CID 47099547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).