N'-(cyclohex-3-ene-1-carbonyl)-4-methoxybenzohydrazide

C15H18N2O3 — CID 2843839

IUPACN'-(cyclohex-3-ene-1-carbonyl)-4-methoxybenzohydrazide
SMILESCOc1ccc(C(=O)NNC(=O)C2CC=CCC2)cc1
InChIInChI=1S/C15H18N2O3/c1-20-13-9-7-12(8-10-13)15(19)17-16-14(18)11-5-3-2-4-6-11/h2-3,7-11H,4-6H2,1H3,(H,16,18)(H,17,19)
InChIKeyBEDYAHSHDZRATA-UHFFFAOYSA-N
MW274.32 g/mol
LogP1.81
Rot. Bonds3

About N'-(cyclohex-3-ene-1-carbonyl)-4-methoxybenzohydrazide

N'-(cyclohex-3-ene-1-carbonyl)-4-methoxybenzohydrazide (PubChem CID 2843839) has the molecular formula C15H18N2O3 and a molecular weight of 274.32 g/mol. Its IUPAC name is N'-(cyclohex-3-ene-1-carbonyl)-4-methoxybenzohydrazide.

Molecular Properties

Compound NameN'-(cyclohex-3-ene-1-carbonyl)-4-methoxybenzohydrazide
PubChem CID2843839
Molecular FormulaC15H18N2O3
Molecular Weight274.32 g/mol
Exact Mass274.13
IUPAC NameN'-(cyclohex-3-ene-1-carbonyl)-4-methoxybenzohydrazide
SMILESCOc1ccc(C(=O)NNC(=O)C2CC=CCC2)cc1
InChIInChI=1S/C15H18N2O3/c1-20-13-9-7-12(8-10-13)15(19)17-16-14(18)11-5-3-2-4-6-11/h2-3,7-11H,4-6H2,1H3,(H,16,18)(H,17,19)
InChIKeyBEDYAHSHDZRATA-UHFFFAOYSA-N
XLogP1.81
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 51.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N'-[2-(4-methoxyanilino)acetyl]cyclohex-3-ene-1-carbohydrazide
CID 18140071
N'-(4-tert-butylcyclohexanecarbonyl)-4-methoxybenzohydrazide
CID 2090870
(1R)-N-(2,4-dimethoxyphenyl)cyclohex-3-ene-1-carboxamide
CID 51469355
(1S)-N'-(cyclopentanecarbonyl)cyclohex-3-ene-1-carbohydrazide
CID 51983300
(1R)-N'-(cyclopentanecarbonyl)cyclohex-3-ene-1-carbohydrazide
CID 51983299
(1S,6R)-6-[[(4-methoxybenzoyl)amino]carbamoyl]-3,4-dimethylcyclohex-3-ene-1-carboxylic acid
CID 842393
(1R)-N-[(2S)-2-hydroxy-3-[(4-methoxyphenyl)methoxy]propyl]cyclohex-3-ene-1-carboxamide
CID 94822861
(1R)-N-[4-(4-methoxyphenyl)-5-methyl-1,3-thiazol-2-yl]cyclohex-3-ene-1-carboxamide
CID 8780972
3-[(cyclohex-3-ene-1-carbonylamino)carbamoyl]-N,N-dimethylbenzenesulfonamide
CID 43001615
(3S)-N'-(4-methoxybenzoyl)-1-pyrimidin-2-ylpiperidine-3-carbohydrazide
CID 7435428
cyclohex-3-en-1-yl-(3-methoxyphenyl)methanone
CID 175706022
(1S,6R)-6-[[(4-cyclopentyloxybenzoyl)amino]carbamoyl]cyclohex-3-ene-1-carboxylic acid
CID 1227808

Frequently Asked Questions

What is the IUPAC name of N'-(cyclohex-3-ene-1-carbonyl)-4-methoxybenzohydrazide?
The IUPAC name of N'-(cyclohex-3-ene-1-carbonyl)-4-methoxybenzohydrazide (CID 2843839) is N'-(cyclohex-3-ene-1-carbonyl)-4-methoxybenzohydrazide.
What is the SMILES notation for N'-(cyclohex-3-ene-1-carbonyl)-4-methoxybenzohydrazide?
The canonical SMILES for N'-(cyclohex-3-ene-1-carbonyl)-4-methoxybenzohydrazide is COc1ccc(C(=O)NNC(=O)C2CC=CCC2)cc1.
What is the InChIKey of N'-(cyclohex-3-ene-1-carbonyl)-4-methoxybenzohydrazide?
The InChIKey is BEDYAHSHDZRATA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O3/c1-20-13-9-7-12(8-10-13)15(19)17-16-14(18)11-5-3-2-4-6-11/h2-3,7-11H,4-6H2,1H3,(H,16,18)(H,17,19).
What are the key properties of N'-(cyclohex-3-ene-1-carbonyl)-4-methoxybenzohydrazide?
N'-(cyclohex-3-ene-1-carbonyl)-4-methoxybenzohydrazide has a molecular weight of 274.32 g/mol, XLogP of 1.81, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(cyclohex-3-ene-1-carbonyl)-4-methoxybenzohydrazide is sourced from PubChem (CID 2843839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).