N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-5-piperidin-1-ylsulfonylfuran-2-carboxamide

C15H18N4O4S2 — CID 55630222

IUPACN-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-5-piperidin-1-ylsulfonylfuran-2-carboxamide
SMILESO=C(Nc1nnc(C2CC2)s1)c1ccc(S(=O)(=O)N2CCCCC2)o1
InChIInChI=1S/C15H18N4O4S2/c20-13(16-15-18-17-14(24-15)10-4-5-10)11-6-7-12(23-11)25(21,22)19-8-2-1-3-9-19/h6-7,10H,1-5,8-9H2,(H,16,18,20)
InChIKeyFPMPOIONAKCXMT-UHFFFAOYSA-N
MW382.47 g/mol
LogP2.44
Rot. Bonds5

About N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-5-piperidin-1-ylsulfonylfuran-2-carboxamide

N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-5-piperidin-1-ylsulfonylfuran-2-carboxamide (PubChem CID 55630222) has the molecular formula C15H18N4O4S2 and a molecular weight of 382.47 g/mol. Its IUPAC name is N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-5-piperidin-1-ylsulfonylfuran-2-carboxamide.

Molecular Properties

Compound NameN-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-5-piperidin-1-ylsulfonylfuran-2-carboxamide
PubChem CID55630222
Molecular FormulaC15H18N4O4S2
Molecular Weight382.47 g/mol
Exact Mass382.08
IUPAC NameN-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-5-piperidin-1-ylsulfonylfuran-2-carboxamide
SMILESO=C(Nc1nnc(C2CC2)s1)c1ccc(S(=O)(=O)N2CCCCC2)o1
InChIInChI=1S/C15H18N4O4S2/c20-13(16-15-18-17-14(24-15)10-4-5-10)11-6-7-12(23-11)25(21,22)19-8-2-1-3-9-19/h6-7,10H,1-5,8-9H2,(H,16,18,20)
InChIKeyFPMPOIONAKCXMT-UHFFFAOYSA-N
XLogP2.44
TPSA105.40 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.47
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-3-morpholin-4-ylsulfonylbenzamide
CID 16572020
N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-5-piperidin-1-ylsulfonylfuran-2-carboxamide
CID 55634612
5-piperidin-1-ylsulfonyl-N-(2-piperidin-1-ylsulfonylphenyl)furan-2-carboxamide
CID 55920724
N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-4-methyl-3-morpholin-4-ylsulfonylbenzamide
CID 8503021
N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-1-(4-fluorophenyl)sulfonylpiperidine-4-carboxamide
CID 27297656
5-(4-acetylphenyl)-N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)furan-2-carboxamide
CID 16572094
methyl 5-pyrrolidin-1-ylsulfonylfuran-2-carboxylate
CID 716787
N-(4-methylsulfonylphenyl)-5-piperidin-1-ylsulfonylfuran-2-carboxamide
CID 55630451
ethyl 4-cyclopropyl-2-[(5-piperidin-1-ylsulfonylfuran-2-carbonyl)amino]thiophene-3-carboxylate
CID 55630530
3-[(5-piperidin-1-ylsulfonylfuran-2-carbonyl)amino]propanoic acid
CID 75417895
1-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-3-[(5-morpholin-4-ylsulfonylthiophen-2-yl)methyl]urea
CID 55695716
N-(2,4-dibromophenyl)-5-piperidin-1-ylsulfonylfuran-2-carboxamide
CID 55631341

Frequently Asked Questions

What is the IUPAC name of N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-5-piperidin-1-ylsulfonylfuran-2-carboxamide?
The IUPAC name of N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-5-piperidin-1-ylsulfonylfuran-2-carboxamide (CID 55630222) is N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-5-piperidin-1-ylsulfonylfuran-2-carboxamide.
What is the SMILES notation for N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-5-piperidin-1-ylsulfonylfuran-2-carboxamide?
The canonical SMILES for N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-5-piperidin-1-ylsulfonylfuran-2-carboxamide is O=C(Nc1nnc(C2CC2)s1)c1ccc(S(=O)(=O)N2CCCCC2)o1.
What is the InChIKey of N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-5-piperidin-1-ylsulfonylfuran-2-carboxamide?
The InChIKey is FPMPOIONAKCXMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O4S2/c20-13(16-15-18-17-14(24-15)10-4-5-10)11-6-7-12(23-11)25(21,22)19-8-2-1-3-9-19/h6-7,10H,1-5,8-9H2,(H,16,18,20).
What are the key properties of N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-5-piperidin-1-ylsulfonylfuran-2-carboxamide?
N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-5-piperidin-1-ylsulfonylfuran-2-carboxamide has a molecular weight of 382.47 g/mol, XLogP of 2.44, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-5-piperidin-1-ylsulfonylfuran-2-carboxamide is sourced from PubChem (CID 55630222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).