furan-2-yl-[4-(3-methylthiophene-2-carbonyl)piperazin-1-yl]methanone

C15H16N2O3S — CID 25163808

IUPACfuran-2-yl-[4-(3-methylthiophene-2-carbonyl)piperazin-1-yl]methanone
SMILESCc1ccsc1C(=O)N1CCN(C(=O)c2ccco2)CC1
InChIInChI=1S/C15H16N2O3S/c1-11-4-10-21-13(11)15(19)17-7-5-16(6-8-17)14(18)12-3-2-9-20-12/h2-4,9-10H,5-8H2,1H3
InChIKeyLWEPBSXRQMZOOG-UHFFFAOYSA-N
MW304.37 g/mol
LogP2.25
Rot. Bonds2

About furan-2-yl-[4-(3-methylthiophene-2-carbonyl)piperazin-1-yl]methanone

furan-2-yl-[4-(3-methylthiophene-2-carbonyl)piperazin-1-yl]methanone (PubChem CID 25163808) has the molecular formula C15H16N2O3S and a molecular weight of 304.37 g/mol. Its IUPAC name is furan-2-yl-[4-(3-methylthiophene-2-carbonyl)piperazin-1-yl]methanone.

Molecular Properties

Compound Namefuran-2-yl-[4-(3-methylthiophene-2-carbonyl)piperazin-1-yl]methanone
PubChem CID25163808
Molecular FormulaC15H16N2O3S
Molecular Weight304.37 g/mol
Exact Mass304.09
IUPAC Namefuran-2-yl-[4-(3-methylthiophene-2-carbonyl)piperazin-1-yl]methanone
SMILESCc1ccsc1C(=O)N1CCN(C(=O)c2ccco2)CC1
InChIInChI=1S/C15H16N2O3S/c1-11-4-10-21-13(11)15(19)17-7-5-16(6-8-17)14(18)12-3-2-9-20-12/h2-4,9-10H,5-8H2,1H3
InChIKeyLWEPBSXRQMZOOG-UHFFFAOYSA-N
XLogP2.25
TPSA53.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.37
LogP ≤ 52.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-(furan-2-ylmethyl)thiophene-2-carboxamide
CID 573774
1-(2-Furoyl)-4-[(phenylthio)acetyl]piperazine
CID 839099
N-[1-{[(2-furylmethyl)amino]carbonyl}-2-(2-thienyl)vinyl]benzamide
CID 2177140
N-({N'-[(1E)-(3-methylthiophen-2-yl)methylidene]hydrazinecarbonyl}methyl)furan-2-carboxamide
CID 9665049
N-(furan-2-ylmethyl)-4,5-dimethylthiophene-2-carboxamide
CID 19585268
1-(2-Furoyl)-4-{[1-(thien-2-ylsulfonyl)piperidin-4-yl]carbonyl}piperazine
CID 3243073
[4-(3-Methyl-furan-2-carbonyl)-piperazin-1-yl]-(3-methyl-furan-2-yl)-methanone
CID 894018
N-Cyclopentyl-2-[furan-2-ylmethyl-(2-thiophen-2-yl-acetyl)-amino]-2-thiophen-3-yl-acetamide
CID 648156
Furan-2-carboxylic acid (cyclohexylcarbamoyl-thiophen-2-yl-methyl)-thiophen-2-ylmethyl-amide
CID 654363
1-(2-Furoyl)-4-(2-thienylsulfonyl)piperazine
CID 756358
2-Cyano-N-furan-2-ylmethyl-3-(3-methyl-thiophen-2-yl)-acrylamide
CID 759842
N-[(1E)-1-[4-(methylsulfanyl)phenyl]-3-(morpholin-4-yl)-3-oxoprop-1-en-2-yl]furan-2-carboxamide
CID 1316409

Frequently Asked Questions

What is the IUPAC name of furan-2-yl-[4-(3-methylthiophene-2-carbonyl)piperazin-1-yl]methanone?
The IUPAC name of furan-2-yl-[4-(3-methylthiophene-2-carbonyl)piperazin-1-yl]methanone (CID 25163808) is furan-2-yl-[4-(3-methylthiophene-2-carbonyl)piperazin-1-yl]methanone.
What is the SMILES notation for furan-2-yl-[4-(3-methylthiophene-2-carbonyl)piperazin-1-yl]methanone?
The canonical SMILES for furan-2-yl-[4-(3-methylthiophene-2-carbonyl)piperazin-1-yl]methanone is Cc1ccsc1C(=O)N1CCN(C(=O)c2ccco2)CC1.
What is the InChIKey of furan-2-yl-[4-(3-methylthiophene-2-carbonyl)piperazin-1-yl]methanone?
The InChIKey is LWEPBSXRQMZOOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O3S/c1-11-4-10-21-13(11)15(19)17-7-5-16(6-8-17)14(18)12-3-2-9-20-12/h2-4,9-10H,5-8H2,1H3.
What are the key properties of furan-2-yl-[4-(3-methylthiophene-2-carbonyl)piperazin-1-yl]methanone?
furan-2-yl-[4-(3-methylthiophene-2-carbonyl)piperazin-1-yl]methanone has a molecular weight of 304.37 g/mol, XLogP of 2.25, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for furan-2-yl-[4-(3-methylthiophene-2-carbonyl)piperazin-1-yl]methanone is sourced from PubChem (CID 25163808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).