N-[4-(4-methylsulfonylpiperazine-1-carbonyl)-1,3-oxazol-2-yl]furan-2-carboxamide

C14H16N4O6S — CID 52907954

IUPACN-[4-(4-methylsulfonylpiperazine-1-carbonyl)-1,3-oxazol-2-yl]furan-2-carboxamide
SMILESCS(=O)(=O)N1CCN(C(=O)c2coc(NC(=O)c3ccco3)n2)CC1
InChIInChI=1S/C14H16N4O6S/c1-25(21,22)18-6-4-17(5-7-18)13(20)10-9-24-14(15-10)16-12(19)11-3-2-8-23-11/h2-3,8-9H,4-7H2,1H3,(H,15,16,19)
InChIKeyGYEOUWSYRBPCHS-UHFFFAOYSA-N
MW368.37 g/mol
LogP0.24
Rot. Bonds4

About N-[4-(4-methylsulfonylpiperazine-1-carbonyl)-1,3-oxazol-2-yl]furan-2-carboxamide

N-[4-(4-methylsulfonylpiperazine-1-carbonyl)-1,3-oxazol-2-yl]furan-2-carboxamide (PubChem CID 52907954) has the molecular formula C14H16N4O6S and a molecular weight of 368.37 g/mol. Its IUPAC name is N-[4-(4-methylsulfonylpiperazine-1-carbonyl)-1,3-oxazol-2-yl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[4-(4-methylsulfonylpiperazine-1-carbonyl)-1,3-oxazol-2-yl]furan-2-carboxamide
PubChem CID52907954
Molecular FormulaC14H16N4O6S
Molecular Weight368.37 g/mol
Exact Mass368.08
IUPAC NameN-[4-(4-methylsulfonylpiperazine-1-carbonyl)-1,3-oxazol-2-yl]furan-2-carboxamide
SMILESCS(=O)(=O)N1CCN(C(=O)c2coc(NC(=O)c3ccco3)n2)CC1
InChIInChI=1S/C14H16N4O6S/c1-25(21,22)18-6-4-17(5-7-18)13(20)10-9-24-14(15-10)16-12(19)11-3-2-8-23-11/h2-3,8-9H,4-7H2,1H3,(H,15,16,19)
InChIKeyGYEOUWSYRBPCHS-UHFFFAOYSA-N
XLogP0.24
TPSA125.96 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.37
LogP ≤ 50.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

N-[4-[4-(2-fluorophenyl)piperazine-1-carbonyl]-1,3-oxazol-2-yl]furan-2-carboxamide
CID 90515113
2-(furan-2-carbonylamino)-N-propan-2-yl-1,3-oxazole-4-carboxamide
CID 90515122
2-(furan-2-carbonylamino)-N-(4-sulfamoylphenyl)-1,3-oxazole-4-carboxamide
CID 90515186
N-[4-(dimethylamino)phenyl]-2-(furan-2-carbonylamino)-1,3-oxazole-4-carboxamide
CID 90515175
N-(3-acetylphenyl)-2-(furan-2-carbonylamino)-1,3-oxazole-4-carboxamide
CID 52907935
N-[4-(4-cyclohexylpiperazine-1-carbonyl)-1,3-oxazol-2-yl]benzamide
CID 90515048
2-(furan-2-carbonylamino)-N-[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]ethyl]-1,3-oxazole-4-carboxamide
CID 90515091
[4-(furan-2-yl)phenyl]-(4-methylsulfonylpiperazin-1-yl)methanone
CID 71690162
N-[4-[4-(4-fluorophenyl)piperazine-1-carbonyl]-1,3-oxazol-2-yl]benzamide
CID 90514908
N-(1-methylsulfonylpyrrolidin-3-yl)furan-2-carboxamide
CID 110871255
N-[2-(4-chlorophenyl)ethyl]-2-(furan-2-carbonylamino)-1,3-oxazole-4-carboxamide
CID 90515222
N-(3-chloro-4-fluorophenyl)-2-(furan-2-carbonylamino)-1,3-oxazole-4-carboxamide
CID 90515189

Frequently Asked Questions

What is the IUPAC name of N-[4-(4-methylsulfonylpiperazine-1-carbonyl)-1,3-oxazol-2-yl]furan-2-carboxamide?
The IUPAC name of N-[4-(4-methylsulfonylpiperazine-1-carbonyl)-1,3-oxazol-2-yl]furan-2-carboxamide (CID 52907954) is N-[4-(4-methylsulfonylpiperazine-1-carbonyl)-1,3-oxazol-2-yl]furan-2-carboxamide.
What is the SMILES notation for N-[4-(4-methylsulfonylpiperazine-1-carbonyl)-1,3-oxazol-2-yl]furan-2-carboxamide?
The canonical SMILES for N-[4-(4-methylsulfonylpiperazine-1-carbonyl)-1,3-oxazol-2-yl]furan-2-carboxamide is CS(=O)(=O)N1CCN(C(=O)c2coc(NC(=O)c3ccco3)n2)CC1.
What is the InChIKey of N-[4-(4-methylsulfonylpiperazine-1-carbonyl)-1,3-oxazol-2-yl]furan-2-carboxamide?
The InChIKey is GYEOUWSYRBPCHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4O6S/c1-25(21,22)18-6-4-17(5-7-18)13(20)10-9-24-14(15-10)16-12(19)11-3-2-8-23-11/h2-3,8-9H,4-7H2,1H3,(H,15,16,19).
What are the key properties of N-[4-(4-methylsulfonylpiperazine-1-carbonyl)-1,3-oxazol-2-yl]furan-2-carboxamide?
N-[4-(4-methylsulfonylpiperazine-1-carbonyl)-1,3-oxazol-2-yl]furan-2-carboxamide has a molecular weight of 368.37 g/mol, XLogP of 0.24, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(4-methylsulfonylpiperazine-1-carbonyl)-1,3-oxazol-2-yl]furan-2-carboxamide is sourced from PubChem (CID 52907954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).