[4-(5-chlorothiophene-2-carbonyl)piperazin-1-yl]-(furan-2-yl)methanone

C14H13ClN2O3S — CID 38911129

IUPAC[4-(5-chlorothiophene-2-carbonyl)piperazin-1-yl]-(furan-2-yl)methanone
SMILESO=C(c1ccco1)N1CCN(C(=O)c2ccc(Cl)s2)CC1
InChIInChI=1S/C14H13ClN2O3S/c15-12-4-3-11(21-12)14(19)17-7-5-16(6-8-17)13(18)10-2-1-9-20-10/h1-4,9H,5-8H2
InChIKeyGDENCULZTRKARH-UHFFFAOYSA-N
MW324.79 g/mol
LogP2.59
Rot. Bonds2

About [4-(5-chlorothiophene-2-carbonyl)piperazin-1-yl]-(furan-2-yl)methanone

[4-(5-chlorothiophene-2-carbonyl)piperazin-1-yl]-(furan-2-yl)methanone (PubChem CID 38911129) has the molecular formula C14H13ClN2O3S and a molecular weight of 324.79 g/mol. Its IUPAC name is [4-(5-chlorothiophene-2-carbonyl)piperazin-1-yl]-(furan-2-yl)methanone.

Molecular Properties

Compound Name[4-(5-chlorothiophene-2-carbonyl)piperazin-1-yl]-(furan-2-yl)methanone
PubChem CID38911129
Molecular FormulaC14H13ClN2O3S
Molecular Weight324.79 g/mol
Exact Mass324.03
IUPAC Name[4-(5-chlorothiophene-2-carbonyl)piperazin-1-yl]-(furan-2-yl)methanone
SMILESO=C(c1ccco1)N1CCN(C(=O)c2ccc(Cl)s2)CC1
InChIInChI=1S/C14H13ClN2O3S/c15-12-4-3-11(21-12)14(19)17-7-5-16(6-8-17)13(18)10-2-1-9-20-10/h1-4,9H,5-8H2
InChIKeyGDENCULZTRKARH-UHFFFAOYSA-N
XLogP2.59
TPSA53.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.79
LogP ≤ 52.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze [4-(5-chlorothiophene-2-carbonyl)piperazin-1-yl]-(furan-2-yl)methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[4-(5-chlorothiophene-2-carbonyl)piperazin-1-yl]ethanone
CID 110696424
[4-(2,6-dichlorobenzoyl)piperazin-1-yl]-(furan-2-yl)methanone
CID 7342085
furan-2-yl(thiomorpholin-4-yl)methanone
CID 2804982
azepan-1-yl(furan-2-yl)methanone
CID 5200992
(4-chlorophenyl)-[4-(5-chlorothiophene-2-carbonyl)piperazin-1-yl]methanone
CID 110802854
N-[2-(5-chlorothiophen-2-yl)ethyl]-4-(furan-2-carbonyl)-N'-methylpiperazine-1-carboximidamide;hydroiodide
CID 111166410
[4-(2,3-dichlorophenyl)piperazin-1-yl]-(furan-2-yl)methanone
CID 113080480
5-[4-(5-chlorothiophene-2-carbonyl)piperazin-1-yl]-2-(furan-2-yl)-1,3-oxazole-4-carbonitrile
CID 46411552
(5-chlorothiophen-2-yl)-(4-ethylpiperazin-1-yl)methanone
CID 25236154
furan-2-yl-[4-[5-(5-phenyl-1,2,4-oxadiazol-3-yl)thiophene-2-carbonyl]piperazin-1-yl]methanone
CID 46388410
[4-(3-chlorophenyl)piperazin-1-yl]-(furan-2-yl)methanone
CID 669410
(4-cyclopropylidenepiperidin-1-yl)-(furan-2-yl)methanone
CID 121184150

Frequently Asked Questions

What is the IUPAC name of [4-(5-chlorothiophene-2-carbonyl)piperazin-1-yl]-(furan-2-yl)methanone?
The IUPAC name of [4-(5-chlorothiophene-2-carbonyl)piperazin-1-yl]-(furan-2-yl)methanone (CID 38911129) is [4-(5-chlorothiophene-2-carbonyl)piperazin-1-yl]-(furan-2-yl)methanone.
What is the SMILES notation for [4-(5-chlorothiophene-2-carbonyl)piperazin-1-yl]-(furan-2-yl)methanone?
The canonical SMILES for [4-(5-chlorothiophene-2-carbonyl)piperazin-1-yl]-(furan-2-yl)methanone is O=C(c1ccco1)N1CCN(C(=O)c2ccc(Cl)s2)CC1.
What is the InChIKey of [4-(5-chlorothiophene-2-carbonyl)piperazin-1-yl]-(furan-2-yl)methanone?
The InChIKey is GDENCULZTRKARH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13ClN2O3S/c15-12-4-3-11(21-12)14(19)17-7-5-16(6-8-17)13(18)10-2-1-9-20-10/h1-4,9H,5-8H2.
What are the key properties of [4-(5-chlorothiophene-2-carbonyl)piperazin-1-yl]-(furan-2-yl)methanone?
[4-(5-chlorothiophene-2-carbonyl)piperazin-1-yl]-(furan-2-yl)methanone has a molecular weight of 324.79 g/mol, XLogP of 2.59, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(5-chlorothiophene-2-carbonyl)piperazin-1-yl]-(furan-2-yl)methanone is sourced from PubChem (CID 38911129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).