5-methyl-N'-[3-(4-phenylpiperazin-1-yl)propanoyl]thiophene-2-carbohydrazide

C19H24N4O2S — CID 26523718

IUPAC5-methyl-N'-[3-(4-phenylpiperazin-1-yl)propanoyl]thiophene-2-carbohydrazide
SMILESCc1ccc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)s1
InChIInChI=1S/C19H24N4O2S/c1-15-7-8-17(26-15)19(25)21-20-18(24)9-10-22-11-13-23(14-12-22)16-5-3-2-4-6-16/h2-8H,9-14H2,1H3,(H,20,24)(H,21,25)
InChIKeySUVUSLBVYPPTKK-UHFFFAOYSA-N
MW372.49 g/mol
LogP2.03
Rot. Bonds5

About 5-methyl-N'-[3-(4-phenylpiperazin-1-yl)propanoyl]thiophene-2-carbohydrazide

5-methyl-N'-[3-(4-phenylpiperazin-1-yl)propanoyl]thiophene-2-carbohydrazide (PubChem CID 26523718) has the molecular formula C19H24N4O2S and a molecular weight of 372.49 g/mol. Its IUPAC name is 5-methyl-N'-[3-(4-phenylpiperazin-1-yl)propanoyl]thiophene-2-carbohydrazide.

Molecular Properties

Compound Name5-methyl-N'-[3-(4-phenylpiperazin-1-yl)propanoyl]thiophene-2-carbohydrazide
PubChem CID26523718
Molecular FormulaC19H24N4O2S
Molecular Weight372.49 g/mol
Exact Mass372.16
IUPAC Name5-methyl-N'-[3-(4-phenylpiperazin-1-yl)propanoyl]thiophene-2-carbohydrazide
SMILESCc1ccc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)s1
InChIInChI=1S/C19H24N4O2S/c1-15-7-8-17(26-15)19(25)21-20-18(24)9-10-22-11-13-23(14-12-22)16-5-3-2-4-6-16/h2-8H,9-14H2,1H3,(H,20,24)(H,21,25)
InChIKeySUVUSLBVYPPTKK-UHFFFAOYSA-N
XLogP2.03
TPSA64.68 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.49
LogP ≤ 52.03
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

3-methyl-N'-[3-(4-phenylpiperazin-1-yl)propanoyl]thiophene-2-carbohydrazide
CID 24979593
4-methyl-N'-[3-(4-phenylpiperazin-1-yl)propanoyl]thiadiazole-5-carbohydrazide
CID 8968237
N'-(3-phenothiazin-10-ylpropanoyl)-3-(4-phenylpiperazin-1-yl)propanehydrazide
CID 4169019
N'-[3-(4-phenylpiperazin-1-yl)propanoyl]-4H-thieno[3,2-c]chromene-2-carbohydrazide
CID 17446228
N'-[3-(4-phenylpiperazin-1-yl)propanoyl]furan-2-carbohydrazide
CID 2677075
N'-[2-(2,6-dimethylphenoxy)acetyl]-3-(4-phenylpiperazin-1-yl)propanehydrazide
CID 7550980
3,4-dimethyl-N-[2-oxo-2-[2-[3-(4-phenylpiperazin-1-yl)propanoyl]hydrazinyl]ethyl]benzamide
CID 18281862
3,5-dichloro-4-methoxy-N'-[3-(4-phenylpiperazin-1-yl)propanoyl]benzohydrazide
CID 29354060
1-benzyl-3,5-dimethyl-N'-[3-(4-phenylpiperazin-1-yl)propanoyl]pyrazole-4-carbohydrazide
CID 26245753
2-chloro-6-fluoro-N'-[3-(4-phenylpiperazin-1-yl)propanoyl]benzohydrazide
CID 7551003
2-chloro-4,5-difluoro-N'-[3-(4-phenylpiperazin-1-yl)propanoyl]benzohydrazide
CID 26523820
(2S)-2-phenoxy-N'-[3-(4-phenylpiperazin-1-yl)propanoyl]propanehydrazide
CID 7551063

Frequently Asked Questions

What is the IUPAC name of 5-methyl-N'-[3-(4-phenylpiperazin-1-yl)propanoyl]thiophene-2-carbohydrazide?
The IUPAC name of 5-methyl-N'-[3-(4-phenylpiperazin-1-yl)propanoyl]thiophene-2-carbohydrazide (CID 26523718) is 5-methyl-N'-[3-(4-phenylpiperazin-1-yl)propanoyl]thiophene-2-carbohydrazide.
What is the SMILES notation for 5-methyl-N'-[3-(4-phenylpiperazin-1-yl)propanoyl]thiophene-2-carbohydrazide?
The canonical SMILES for 5-methyl-N'-[3-(4-phenylpiperazin-1-yl)propanoyl]thiophene-2-carbohydrazide is Cc1ccc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)s1.
What is the InChIKey of 5-methyl-N'-[3-(4-phenylpiperazin-1-yl)propanoyl]thiophene-2-carbohydrazide?
The InChIKey is SUVUSLBVYPPTKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O2S/c1-15-7-8-17(26-15)19(25)21-20-18(24)9-10-22-11-13-23(14-12-22)16-5-3-2-4-6-16/h2-8H,9-14H2,1H3,(H,20,24)(H,21,25).
What are the key properties of 5-methyl-N'-[3-(4-phenylpiperazin-1-yl)propanoyl]thiophene-2-carbohydrazide?
5-methyl-N'-[3-(4-phenylpiperazin-1-yl)propanoyl]thiophene-2-carbohydrazide has a molecular weight of 372.49 g/mol, XLogP of 2.03, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N'-[3-(4-phenylpiperazin-1-yl)propanoyl]thiophene-2-carbohydrazide is sourced from PubChem (CID 26523718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).