4-(5-cyclopentyl-1,3,4-oxadiazol-2-yl)-N-methyl-N-propylfuran-2-sulfonamide

C15H21N3O4S — CID 53175918

IUPAC4-(5-cyclopentyl-1,3,4-oxadiazol-2-yl)-N-methyl-N-propylfuran-2-sulfonamide
SMILESCCCN(C)S(=O)(=O)c1cc(-c2nnc(C3CCCC3)o2)co1
InChIInChI=1S/C15H21N3O4S/c1-3-8-18(2)23(19,20)13-9-12(10-21-13)15-17-16-14(22-15)11-6-4-5-7-11/h9-11H,3-8H2,1-2H3
InChIKeyIGPCBPKICVDCLV-UHFFFAOYSA-N
MW339.42 g/mol
LogP3.02
Rot. Bonds6

About 4-(5-cyclopentyl-1,3,4-oxadiazol-2-yl)-N-methyl-N-propylfuran-2-sulfonamide

4-(5-cyclopentyl-1,3,4-oxadiazol-2-yl)-N-methyl-N-propylfuran-2-sulfonamide (PubChem CID 53175918) has the molecular formula C15H21N3O4S and a molecular weight of 339.42 g/mol. Its IUPAC name is 4-(5-cyclopentyl-1,3,4-oxadiazol-2-yl)-N-methyl-N-propylfuran-2-sulfonamide.

Molecular Properties

Compound Name4-(5-cyclopentyl-1,3,4-oxadiazol-2-yl)-N-methyl-N-propylfuran-2-sulfonamide
PubChem CID53175918
Molecular FormulaC15H21N3O4S
Molecular Weight339.42 g/mol
Exact Mass339.13
IUPAC Name4-(5-cyclopentyl-1,3,4-oxadiazol-2-yl)-N-methyl-N-propylfuran-2-sulfonamide
SMILESCCCN(C)S(=O)(=O)c1cc(-c2nnc(C3CCCC3)o2)co1
InChIInChI=1S/C15H21N3O4S/c1-3-8-18(2)23(19,20)13-9-12(10-21-13)15-17-16-14(22-15)11-6-4-5-7-11/h9-11H,3-8H2,1-2H3
InChIKeyIGPCBPKICVDCLV-UHFFFAOYSA-N
XLogP3.02
TPSA89.44 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.42
LogP ≤ 53.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

2-Methyl-5-{5-[(4-methylpiperazino)sulfonyl]-3-furyl}-1,3,4-oxadiazole
CID 53175730
N-butyl-N-ethyl-4-(5-methyl-1,3,4-oxadiazol-2-yl)furan-2-sulfonamide
CID 53175746
N-butyl-N-methyl-4-(5-methyl-1,3,4-oxadiazol-2-yl)furan-2-sulfonamide
CID 53175749
N-methyl-4-(5-methyl-1,3,4-oxadiazol-2-yl)-N-propylfuran-2-sulfonamide
CID 53175763
1-{[4-(5-Ethyl-1,3,4-oxadiazol-2-yl)-2-furyl]sulfonyl}-4-methylpiperidine
CID 53175781
4-Methyl-1-({4-[5-(propan-2-YL)-1,3,4-oxadiazol-2-YL]furan-2-YL}sulfonyl)piperidine
CID 53175813
4-{4-[5-(Propan-2-yl)-1,3,4-oxadiazol-2-yl]furan-2-sulfonyl}morpholine
CID 53175838
1'-[4-(5-Cyclobutyl-1,3,4-oxadiazol-2-yl)furan-2-sulfonyl]-1,4'-bipiperidine
CID 53175894
1-[4-(5-Cyclopentyl-1,3,4-oxadiazol-2-yl)furan-2-sulfonyl]-4-(propan-2-yl)piperazine
CID 53175916
1-Butyl-4-{[4-(5-cyclopentyl-1,3,4-oxadiazol-2-yl)-2-furyl]sulfonyl}piperazine
CID 53175920
2-[5-[(2S)-2-methylpiperidin-1-yl]sulfonylfuran-3-yl]-5-propan-2-yl-1,3,4-oxadiazole
CID 95103481
N-cyclohexyl-N-methyl-4-(5-methyl-1,3,4-oxadiazol-2-yl)furan-2-sulfonamide
CID 53175727

Frequently Asked Questions

What is the IUPAC name of 4-(5-cyclopentyl-1,3,4-oxadiazol-2-yl)-N-methyl-N-propylfuran-2-sulfonamide?
The IUPAC name of 4-(5-cyclopentyl-1,3,4-oxadiazol-2-yl)-N-methyl-N-propylfuran-2-sulfonamide (CID 53175918) is 4-(5-cyclopentyl-1,3,4-oxadiazol-2-yl)-N-methyl-N-propylfuran-2-sulfonamide.
What is the SMILES notation for 4-(5-cyclopentyl-1,3,4-oxadiazol-2-yl)-N-methyl-N-propylfuran-2-sulfonamide?
The canonical SMILES for 4-(5-cyclopentyl-1,3,4-oxadiazol-2-yl)-N-methyl-N-propylfuran-2-sulfonamide is CCCN(C)S(=O)(=O)c1cc(-c2nnc(C3CCCC3)o2)co1.
What is the InChIKey of 4-(5-cyclopentyl-1,3,4-oxadiazol-2-yl)-N-methyl-N-propylfuran-2-sulfonamide?
The InChIKey is IGPCBPKICVDCLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O4S/c1-3-8-18(2)23(19,20)13-9-12(10-21-13)15-17-16-14(22-15)11-6-4-5-7-11/h9-11H,3-8H2,1-2H3.
What are the key properties of 4-(5-cyclopentyl-1,3,4-oxadiazol-2-yl)-N-methyl-N-propylfuran-2-sulfonamide?
4-(5-cyclopentyl-1,3,4-oxadiazol-2-yl)-N-methyl-N-propylfuran-2-sulfonamide has a molecular weight of 339.42 g/mol, XLogP of 3.02, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-cyclopentyl-1,3,4-oxadiazol-2-yl)-N-methyl-N-propylfuran-2-sulfonamide is sourced from PubChem (CID 53175918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).