N-[(2R)-1-(furan-2-yl)propan-2-yl]-4-(methanesulfonamido)piperidine-1-carboxamide

C14H23N3O4S — CID 95383461

IUPACN-[(2R)-1-(furan-2-yl)propan-2-yl]-4-(methanesulfonamido)piperidine-1-carboxamide
SMILESC[C@H](Cc1ccco1)NC(=O)N1CCC(NS(C)(=O)=O)CC1
InChIInChI=1S/C14H23N3O4S/c1-11(10-13-4-3-9-21-13)15-14(18)17-7-5-12(6-8-17)16-22(2,19)20/h3-4,9,11-12,16H,5-8,10H2,1-2H3,(H,15,18)/t11-/m1/s1
InChIKeyXLEROZJNYHZBHQ-LLVKDONJSA-N
MW329.42 g/mol
LogP0.93
Rot. Bonds5

About N-[(2R)-1-(furan-2-yl)propan-2-yl]-4-(methanesulfonamido)piperidine-1-carboxamide

N-[(2R)-1-(furan-2-yl)propan-2-yl]-4-(methanesulfonamido)piperidine-1-carboxamide (PubChem CID 95383461) has the molecular formula C14H23N3O4S and a molecular weight of 329.42 g/mol. Its IUPAC name is N-[(2R)-1-(furan-2-yl)propan-2-yl]-4-(methanesulfonamido)piperidine-1-carboxamide.

Molecular Properties

Compound NameN-[(2R)-1-(furan-2-yl)propan-2-yl]-4-(methanesulfonamido)piperidine-1-carboxamide
PubChem CID95383461
Molecular FormulaC14H23N3O4S
Molecular Weight329.42 g/mol
Exact Mass329.14
IUPAC NameN-[(2R)-1-(furan-2-yl)propan-2-yl]-4-(methanesulfonamido)piperidine-1-carboxamide
SMILESC[C@H](Cc1ccco1)NC(=O)N1CCC(NS(C)(=O)=O)CC1
InChIInChI=1S/C14H23N3O4S/c1-11(10-13-4-3-9-21-13)15-14(18)17-7-5-12(6-8-17)16-22(2,19)20/h3-4,9,11-12,16H,5-8,10H2,1-2H3,(H,15,18)/t11-/m1/s1
InChIKeyXLEROZJNYHZBHQ-LLVKDONJSA-N
XLogP0.93
TPSA91.65 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.42
LogP ≤ 50.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 97087871
3-acetamido-N-[1-(furan-2-yl)propan-2-yl]piperidine-1-carboxamide
CID 71893038
2-[1-[1-(furan-2-yl)propan-2-ylcarbamoyl]azetidin-3-yl]propanoic acid
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N-[(2S)-1-(furan-2-yl)propan-2-yl]-3,4-dihydro-1H-isoquinoline-2-carboxamide
CID 35684027
(3S)-N-[(2S)-1-(furan-2-yl)propan-2-yl]-3-pyridin-3-yloxypyrrolidine-1-carboxamide
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N-[(2S)-1-(furan-2-yl)propan-2-yl]-1-sulfamoylpiperidine-4-carboxamide
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(3R)-N-[(2S)-1-(furan-2-yl)propan-2-yl]-1-methylsulfonylpiperidine-3-carboxamide
CID 94022233
(2R)-N-[(2R)-1-(furan-2-yl)propan-2-yl]-2-methylsulfonylpropanamide
CID 94171682
(2R)-N-[(2R)-1-(furan-2-yl)propan-2-yl]-2-phenylpyrrolidine-1-carboxamide
CID 96554428
4-[1-(furan-2-yl)propan-2-ylcarbamoyl]thiomorpholine-3-carboxylic acid
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Frequently Asked Questions

What is the IUPAC name of N-[(2R)-1-(furan-2-yl)propan-2-yl]-4-(methanesulfonamido)piperidine-1-carboxamide?
The IUPAC name of N-[(2R)-1-(furan-2-yl)propan-2-yl]-4-(methanesulfonamido)piperidine-1-carboxamide (CID 95383461) is N-[(2R)-1-(furan-2-yl)propan-2-yl]-4-(methanesulfonamido)piperidine-1-carboxamide.
What is the SMILES notation for N-[(2R)-1-(furan-2-yl)propan-2-yl]-4-(methanesulfonamido)piperidine-1-carboxamide?
The canonical SMILES for N-[(2R)-1-(furan-2-yl)propan-2-yl]-4-(methanesulfonamido)piperidine-1-carboxamide is C[C@H](Cc1ccco1)NC(=O)N1CCC(NS(C)(=O)=O)CC1.
What is the InChIKey of N-[(2R)-1-(furan-2-yl)propan-2-yl]-4-(methanesulfonamido)piperidine-1-carboxamide?
The InChIKey is XLEROZJNYHZBHQ-LLVKDONJSA-N. The full InChI is InChI=1S/C14H23N3O4S/c1-11(10-13-4-3-9-21-13)15-14(18)17-7-5-12(6-8-17)16-22(2,19)20/h3-4,9,11-12,16H,5-8,10H2,1-2H3,(H,15,18)/t11-/m1/s1.
What are the key properties of N-[(2R)-1-(furan-2-yl)propan-2-yl]-4-(methanesulfonamido)piperidine-1-carboxamide?
N-[(2R)-1-(furan-2-yl)propan-2-yl]-4-(methanesulfonamido)piperidine-1-carboxamide has a molecular weight of 329.42 g/mol, XLogP of 0.93, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-1-(furan-2-yl)propan-2-yl]-4-(methanesulfonamido)piperidine-1-carboxamide is sourced from PubChem (CID 95383461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).