N-[(2S)-1-(furan-2-yl)propan-2-yl]-1-sulfamoylpiperidine-4-carboxamide

C13H21N3O4S — CID 32598215

IUPACN-[(2S)-1-(furan-2-yl)propan-2-yl]-1-sulfamoylpiperidine-4-carboxamide
SMILESC[C@@H](Cc1ccco1)NC(=O)C1CCN(S(N)(=O)=O)CC1
InChIInChI=1S/C13H21N3O4S/c1-10(9-12-3-2-8-20-12)15-13(17)11-4-6-16(7-5-11)21(14,18)19/h2-3,8,10-11H,4-7,9H2,1H3,(H,15,17)(H2,14,18,19)/t10-/m0/s1
InChIKeyJVHRMWIVTLOUKK-JTQLQIEISA-N
MW315.39 g/mol
LogP0.24
Rot. Bonds5

About N-[(2S)-1-(furan-2-yl)propan-2-yl]-1-sulfamoylpiperidine-4-carboxamide

N-[(2S)-1-(furan-2-yl)propan-2-yl]-1-sulfamoylpiperidine-4-carboxamide (PubChem CID 32598215) has the molecular formula C13H21N3O4S and a molecular weight of 315.39 g/mol. Its IUPAC name is N-[(2S)-1-(furan-2-yl)propan-2-yl]-1-sulfamoylpiperidine-4-carboxamide.

Molecular Properties

Compound NameN-[(2S)-1-(furan-2-yl)propan-2-yl]-1-sulfamoylpiperidine-4-carboxamide
PubChem CID32598215
Molecular FormulaC13H21N3O4S
Molecular Weight315.39 g/mol
Exact Mass315.13
IUPAC NameN-[(2S)-1-(furan-2-yl)propan-2-yl]-1-sulfamoylpiperidine-4-carboxamide
SMILESC[C@@H](Cc1ccco1)NC(=O)C1CCN(S(N)(=O)=O)CC1
InChIInChI=1S/C13H21N3O4S/c1-10(9-12-3-2-8-20-12)15-13(17)11-4-6-16(7-5-11)21(14,18)19/h2-3,8,10-11H,4-7,9H2,1H3,(H,15,17)(H2,14,18,19)/t10-/m0/s1
InChIKeyJVHRMWIVTLOUKK-JTQLQIEISA-N
XLogP0.24
TPSA105.64 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.39
LogP ≤ 50.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(3R)-N-[(2S)-1-(furan-2-yl)propan-2-yl]-1-methylsulfonylpiperidine-3-carboxamide
CID 94022233
N-[1-(furan-2-yl)propan-2-yl]-1-(1-methylindol-5-yl)sulfonylpiperidine-4-carboxamide
CID 20966138
N-[(2R)-1-(furan-2-yl)propan-2-yl]-1-[(3-methyl-2-oxo-1,3-benzothiazol-6-yl)sulfonyl]piperidine-4-carboxamide
CID 95085354
N-[1-(furan-2-yl)propan-2-yl]-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide
CID 55614736
N-[1-(furan-2-yl)propan-2-yl]-1-[(3-oxo-4H-1,4-benzoxazin-6-yl)sulfonyl]piperidine-4-carboxamide
CID 53068467
N-[(2R)-4-(furan-2-yl)butan-2-yl]-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide
CID 9141771
N-[1-(furan-2-yl)propan-2-yl]-2-methylpiperidine-4-carboxamide
CID 106738994
1-[[5-[(E)-2-(2-fluorophenyl)ethenyl]-3-methyl-1,2-oxazol-4-yl]sulfonyl]-N-[(2R)-1-(furan-2-yl)propan-2-yl]piperidine-4-carboxamide
CID 92875149
N-[(2R)-1-(furan-2-yl)propan-2-yl]-1-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)piperidine-4-carboxamide
CID 92869993
N-[(2S)-1-(furan-2-yl)propan-2-yl]-1-(4-methyl-3-oxopyrido[2,3-b]pyrazin-2-yl)piperidine-4-carboxamide
CID 92869716
N-[(2R)-1-(furan-2-yl)propan-2-yl]-4-(methanesulfonamido)piperidine-1-carboxamide
CID 95383461
N-(furan-2-ylmethyl)-1-piperidin-1-ylsulfonylpiperidine-4-carboxamide
CID 3463565

Frequently Asked Questions

What is the IUPAC name of N-[(2S)-1-(furan-2-yl)propan-2-yl]-1-sulfamoylpiperidine-4-carboxamide?
The IUPAC name of N-[(2S)-1-(furan-2-yl)propan-2-yl]-1-sulfamoylpiperidine-4-carboxamide (CID 32598215) is N-[(2S)-1-(furan-2-yl)propan-2-yl]-1-sulfamoylpiperidine-4-carboxamide.
What is the SMILES notation for N-[(2S)-1-(furan-2-yl)propan-2-yl]-1-sulfamoylpiperidine-4-carboxamide?
The canonical SMILES for N-[(2S)-1-(furan-2-yl)propan-2-yl]-1-sulfamoylpiperidine-4-carboxamide is C[C@@H](Cc1ccco1)NC(=O)C1CCN(S(N)(=O)=O)CC1.
What is the InChIKey of N-[(2S)-1-(furan-2-yl)propan-2-yl]-1-sulfamoylpiperidine-4-carboxamide?
The InChIKey is JVHRMWIVTLOUKK-JTQLQIEISA-N. The full InChI is InChI=1S/C13H21N3O4S/c1-10(9-12-3-2-8-20-12)15-13(17)11-4-6-16(7-5-11)21(14,18)19/h2-3,8,10-11H,4-7,9H2,1H3,(H,15,17)(H2,14,18,19)/t10-/m0/s1.
What are the key properties of N-[(2S)-1-(furan-2-yl)propan-2-yl]-1-sulfamoylpiperidine-4-carboxamide?
N-[(2S)-1-(furan-2-yl)propan-2-yl]-1-sulfamoylpiperidine-4-carboxamide has a molecular weight of 315.39 g/mol, XLogP of 0.24, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2S)-1-(furan-2-yl)propan-2-yl]-1-sulfamoylpiperidine-4-carboxamide is sourced from PubChem (CID 32598215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).