1-(2,5-diethylfuran-3-yl)-1-[(1-methylpiperidin-3-yl)-(1-methylpyrazol-4-yl)sulfamoyl]urea

C19H30N6O4S — CID 175713048

IUPAC1-(2,5-diethylfuran-3-yl)-1-[(1-methylpiperidin-3-yl)-(1-methylpyrazol-4-yl)sulfamoyl]urea
SMILESCCc1cc(N(C(N)=O)S(=O)(=O)N(c2cnn(C)c2)C2CCCN(C)C2)c(CC)o1
InChIInChI=1S/C19H30N6O4S/c1-5-16-10-17(18(6-2)29-16)25(19(20)26)30(27,28)24(15-11-21-23(4)13-15)14-8-7-9-22(3)12-14/h10-11,13-14H,5-9,12H2,1-4H3,(H2,20,26)
InChIKeyXQDQNEFMJHCTDW-UHFFFAOYSA-N
MW438.55 g/mol
LogP1.87
Rot. Bonds7

About 1-(2,5-diethylfuran-3-yl)-1-[(1-methylpiperidin-3-yl)-(1-methylpyrazol-4-yl)sulfamoyl]urea

1-(2,5-diethylfuran-3-yl)-1-[(1-methylpiperidin-3-yl)-(1-methylpyrazol-4-yl)sulfamoyl]urea (PubChem CID 175713048) has the molecular formula C19H30N6O4S and a molecular weight of 438.55 g/mol. Its IUPAC name is 1-(2,5-diethylfuran-3-yl)-1-[(1-methylpiperidin-3-yl)-(1-methylpyrazol-4-yl)sulfamoyl]urea.

Molecular Properties

Compound Name1-(2,5-diethylfuran-3-yl)-1-[(1-methylpiperidin-3-yl)-(1-methylpyrazol-4-yl)sulfamoyl]urea
PubChem CID175713048
Molecular FormulaC19H30N6O4S
Molecular Weight438.55 g/mol
Exact Mass438.20
IUPAC Name1-(2,5-diethylfuran-3-yl)-1-[(1-methylpiperidin-3-yl)-(1-methylpyrazol-4-yl)sulfamoyl]urea
SMILESCCc1cc(N(C(N)=O)S(=O)(=O)N(c2cnn(C)c2)C2CCCN(C)C2)c(CC)o1
InChIInChI=1S/C19H30N6O4S/c1-5-16-10-17(18(6-2)29-16)25(19(20)26)30(27,28)24(15-11-21-23(4)13-15)14-8-7-9-22(3)12-14/h10-11,13-14H,5-9,12H2,1-4H3,(H2,20,26)
InChIKeyXQDQNEFMJHCTDW-UHFFFAOYSA-N
XLogP1.87
TPSA117.91 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500438.55
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 1-(2,5-diethylfuran-3-yl)-1-[(1-methylpiperidin-3-yl)-(1-methylpyrazol-4-yl)sulfamoyl]urea 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-(2,5-dimethylthiophen-3-yl)-1-[(1-methylpiperidin-3-yl)-(1-methylpyrazol-4-yl)sulfamoyl]urea
CID 175712963
1-(2,4-diethylthiophen-3-yl)-1-[(1-methylpiperidin-3-yl)-(1-methylpyrazol-4-yl)sulfamoyl]urea
CID 175712998
1-[2,5-di(propan-2-yl)thiophen-3-yl]-1-[[(3R)-1-methylpiperidin-3-yl]-(1-propan-2-ylpyrazol-4-yl)sulfamoyl]urea
CID 175712985
(3S)-1-methyl-3-[(1-methylpyrazol-4-yl)-sulfamoylamino]piperidine;hydrochloride
CID 155389382
1-(2-ethyl-5-propan-2-ylfuran-3-yl)-3-[(1-methylpiperidin-3-yl)-(1-methylpyrazol-4-yl)amino]sulfanylurea
CID 155737703
[2-methyl-1-[(1-methylpiperidin-3-yl)-(1-methylpyrazol-4-yl)sulfamoyl]propan-2-yl]carbamoyl 2,2,2-trifluoroacetate
CID 175108911
N-(1-methylpiperidin-3-yl)-N-(1-methylpyrazol-4-yl)thiohydroxylamine
CID 155737799
1-(5-chloro-2-propan-2-ylthiophen-3-yl)-3-[[(3S)-1-methylpiperidin-3-yl]-(1-methylpyrazol-4-yl)sulfamoyl]urea
CID 155388875
1-methyl-3-[(1-methylpyrazol-4-yl)-sulfinatoamino]piperidine
CID 155396534
2-(3,5-dimethylphenyl)-N-[(1-methylpiperidin-3-yl)-(1-methylpyrazol-4-yl)sulfinamoyl]acetamide
CID 155396509
sodium (3-chloro-5-propan-2-ylphenyl)carbamoyl-[(1-methylpiperidin-3-yl)-(1-methylpyrazol-4-yl)sulfamoyl]azanide
CID 158189065
1-(2-ethyl-5-propan-2-ylthiophen-3-yl)-3-[[(3S)-1-[[2-methyl-4-[[(3S)-1-methylpiperidin-3-yl]-[(2-methyl-5-propan-2-ylthiophen-3-yl)carbamoylsulfamoyl]amino]pyrazol-2-ium-1-yl]methyl]piperidin-3-yl]-(1-methylpyrazol-4-yl)sulfamoyl]urea
CID 155737716

Frequently Asked Questions

What is the IUPAC name of 1-(2,5-diethylfuran-3-yl)-1-[(1-methylpiperidin-3-yl)-(1-methylpyrazol-4-yl)sulfamoyl]urea?
The IUPAC name of 1-(2,5-diethylfuran-3-yl)-1-[(1-methylpiperidin-3-yl)-(1-methylpyrazol-4-yl)sulfamoyl]urea (CID 175713048) is 1-(2,5-diethylfuran-3-yl)-1-[(1-methylpiperidin-3-yl)-(1-methylpyrazol-4-yl)sulfamoyl]urea.
What is the SMILES notation for 1-(2,5-diethylfuran-3-yl)-1-[(1-methylpiperidin-3-yl)-(1-methylpyrazol-4-yl)sulfamoyl]urea?
The canonical SMILES for 1-(2,5-diethylfuran-3-yl)-1-[(1-methylpiperidin-3-yl)-(1-methylpyrazol-4-yl)sulfamoyl]urea is CCc1cc(N(C(N)=O)S(=O)(=O)N(c2cnn(C)c2)C2CCCN(C)C2)c(CC)o1.
What is the InChIKey of 1-(2,5-diethylfuran-3-yl)-1-[(1-methylpiperidin-3-yl)-(1-methylpyrazol-4-yl)sulfamoyl]urea?
The InChIKey is XQDQNEFMJHCTDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30N6O4S/c1-5-16-10-17(18(6-2)29-16)25(19(20)26)30(27,28)24(15-11-21-23(4)13-15)14-8-7-9-22(3)12-14/h10-11,13-14H,5-9,12H2,1-4H3,(H2,20,26).
What are the key properties of 1-(2,5-diethylfuran-3-yl)-1-[(1-methylpiperidin-3-yl)-(1-methylpyrazol-4-yl)sulfamoyl]urea?
1-(2,5-diethylfuran-3-yl)-1-[(1-methylpiperidin-3-yl)-(1-methylpyrazol-4-yl)sulfamoyl]urea has a molecular weight of 438.55 g/mol, XLogP of 1.87, 7 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,5-diethylfuran-3-yl)-1-[(1-methylpiperidin-3-yl)-(1-methylpyrazol-4-yl)sulfamoyl]urea is sourced from PubChem (CID 175713048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).