N'-[3-(2-methoxyphenyl)propanoyl]thiophene-2-carbohydrazide

C15H16N2O3S — CID 4790874

IUPACN'-[3-(2-methoxyphenyl)propanoyl]thiophene-2-carbohydrazide
SMILESCOc1ccccc1CCC(=O)NNC(=O)c1cccs1
InChIInChI=1S/C15H16N2O3S/c1-20-12-6-3-2-5-11(12)8-9-14(18)16-17-15(19)13-7-4-10-21-13/h2-7,10H,8-9H2,1H3,(H,16,18)(H,17,19)
InChIKeyFJZSLHHBVWUIKG-UHFFFAOYSA-N
MW304.37 g/mol
LogP2.15
Rot. Bonds5

About N'-[3-(2-methoxyphenyl)propanoyl]thiophene-2-carbohydrazide

N'-[3-(2-methoxyphenyl)propanoyl]thiophene-2-carbohydrazide (PubChem CID 4790874) has the molecular formula C15H16N2O3S and a molecular weight of 304.37 g/mol. Its IUPAC name is N'-[3-(2-methoxyphenyl)propanoyl]thiophene-2-carbohydrazide.

Molecular Properties

Compound NameN'-[3-(2-methoxyphenyl)propanoyl]thiophene-2-carbohydrazide
PubChem CID4790874
Molecular FormulaC15H16N2O3S
Molecular Weight304.37 g/mol
Exact Mass304.09
IUPAC NameN'-[3-(2-methoxyphenyl)propanoyl]thiophene-2-carbohydrazide
SMILESCOc1ccccc1CCC(=O)NNC(=O)c1cccs1
InChIInChI=1S/C15H16N2O3S/c1-20-12-6-3-2-5-11(12)8-9-14(18)16-17-15(19)13-7-4-10-21-13/h2-7,10H,8-9H2,1H3,(H,16,18)(H,17,19)
InChIKeyFJZSLHHBVWUIKG-UHFFFAOYSA-N
XLogP2.15
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.37
LogP ≤ 52.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-[(E)-[(E)-3-(2-methoxyphenyl)prop-2-enylidene]amino]thiophene-2-carboxamide
CID 6861722
4-methoxy-N'-(2-thienylacetyl)benzohydrazide
CID 748727
N'-[2-(2-methoxyphenyl)acetyl]thiophene-2-carbohydrazide
CID 809222
3,5-dimethoxy-N'-(2-thiophen-2-ylacetyl)benzohydrazide
CID 2102438
N'-(5-chloro-2-methoxybenzoyl)thiophene-2-carbohydrazide
CID 2408294
2-methoxy-N-[2-oxo-2-[2-(thiophene-2-carbonyl)hydrazinyl]ethyl]benzamide
CID 4787489
5-bromo-N'-[2-(3,4-dimethoxyphenyl)acetyl]thiophene-2-carbohydrazide
CID 4788528
N'-[(E)-3-(2-methoxyphenyl)prop-2-enoyl]thiophene-2-carbohydrazide
CID 969141
(E)-3-(4-methoxyphenyl)-N-[(thiophene-2-carbonylamino)carbamothioyl]prop-2-enamide
CID 1932984
(E)-N-[[(4-methoxybenzoyl)amino]carbamothioyl]-3-thiophen-2-ylprop-2-enamide
CID 1933036
N-[[(4-propoxybenzoyl)amino]carbamothioyl]thiophene-2-carboxamide
CID 1933111
N'-(2-methoxybenzylidene)-4,5-dimethyl-3-thiophenecarbohydrazide
CID 9564820

Frequently Asked Questions

What is the IUPAC name of N'-[3-(2-methoxyphenyl)propanoyl]thiophene-2-carbohydrazide?
The IUPAC name of N'-[3-(2-methoxyphenyl)propanoyl]thiophene-2-carbohydrazide (CID 4790874) is N'-[3-(2-methoxyphenyl)propanoyl]thiophene-2-carbohydrazide.
What is the SMILES notation for N'-[3-(2-methoxyphenyl)propanoyl]thiophene-2-carbohydrazide?
The canonical SMILES for N'-[3-(2-methoxyphenyl)propanoyl]thiophene-2-carbohydrazide is COc1ccccc1CCC(=O)NNC(=O)c1cccs1.
What is the InChIKey of N'-[3-(2-methoxyphenyl)propanoyl]thiophene-2-carbohydrazide?
The InChIKey is FJZSLHHBVWUIKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O3S/c1-20-12-6-3-2-5-11(12)8-9-14(18)16-17-15(19)13-7-4-10-21-13/h2-7,10H,8-9H2,1H3,(H,16,18)(H,17,19).
What are the key properties of N'-[3-(2-methoxyphenyl)propanoyl]thiophene-2-carbohydrazide?
N'-[3-(2-methoxyphenyl)propanoyl]thiophene-2-carbohydrazide has a molecular weight of 304.37 g/mol, XLogP of 2.15, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[3-(2-methoxyphenyl)propanoyl]thiophene-2-carbohydrazide is sourced from PubChem (CID 4790874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).