(2R)-N,N-dimethyl-2-[(3R)-3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]sulfonylpropanamide

C14H24N4O4S — CID 124829296

IUPAC(2R)-N,N-dimethyl-2-[(3R)-3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]sulfonylpropanamide
SMILESCc1nc(C[C@H]2CCCN(S(=O)(=O)[C@H](C)C(=O)N(C)C)C2)no1
InChIInChI=1S/C14H24N4O4S/c1-10(14(19)17(3)4)23(20,21)18-7-5-6-12(9-18)8-13-15-11(2)22-16-13/h10,12H,5-9H2,1-4H3/t10-,12-/m1/s1
InChIKeyAOTFWQKHASPZRJ-ZYHUDNBSSA-N
MW344.44 g/mol
LogP0.44
Rot. Bonds5

About (2R)-N,N-dimethyl-2-[(3R)-3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]sulfonylpropanamide

(2R)-N,N-dimethyl-2-[(3R)-3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]sulfonylpropanamide (PubChem CID 124829296) has the molecular formula C14H24N4O4S and a molecular weight of 344.44 g/mol. Its IUPAC name is (2R)-N,N-dimethyl-2-[(3R)-3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]sulfonylpropanamide.

Molecular Properties

Compound Name(2R)-N,N-dimethyl-2-[(3R)-3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]sulfonylpropanamide
PubChem CID124829296
Molecular FormulaC14H24N4O4S
Molecular Weight344.44 g/mol
Exact Mass344.15
IUPAC Name(2R)-N,N-dimethyl-2-[(3R)-3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]sulfonylpropanamide
SMILESCc1nc(C[C@H]2CCCN(S(=O)(=O)[C@H](C)C(=O)N(C)C)C2)no1
InChIInChI=1S/C14H24N4O4S/c1-10(14(19)17(3)4)23(20,21)18-7-5-6-12(9-18)8-13-15-11(2)22-16-13/h10,12H,5-9H2,1-4H3/t10-,12-/m1/s1
InChIKeyAOTFWQKHASPZRJ-ZYHUDNBSSA-N
XLogP0.44
TPSA96.61 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.44
LogP ≤ 50.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

(3R)-N-[(2S)-2-cyanopropyl]-N-methyl-3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-1-sulfonamide
CID 124875045
4-amino-1-[3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]pentan-1-one
CID 120562335
ethyl (2S)-2-[(3R)-3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]propanoate
CID 124628859
2-methyl-3-(methylamino)-1-[3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]propan-1-one;hydrochloride
CID 119775640
2-(1-aminocyclobutyl)-1-[(3R)-3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]ethanone
CID 124697978
3-(hydroxymethyl)-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-1-sulfonamide
CID 106410338
2-(5-methyl-1,2,4-oxadiazol-3-yl)-N-[(1-methylsulfonylpiperidin-3-yl)methyl]ethanamine
CID 103746439
(2S)-2-amino-3,3-dimethyl-1-[3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]butan-1-one;hydrochloride
CID 119775634
3-(hydroxymethyl)-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]piperidine-1-sulfonamide
CID 106423465
(2S)-2-amino-1-[(3S)-3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]-4-methylsulfanylbutan-1-one
CID 124594397
3-[3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]-1-piperazin-1-ylpropan-1-one;hydrochloride
CID 120981550
[(3R)-3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]-(5-propan-2-yl-1H-pyrazol-4-yl)methanone
CID 124626357

Frequently Asked Questions

What is the IUPAC name of (2R)-N,N-dimethyl-2-[(3R)-3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]sulfonylpropanamide?
The IUPAC name of (2R)-N,N-dimethyl-2-[(3R)-3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]sulfonylpropanamide (CID 124829296) is (2R)-N,N-dimethyl-2-[(3R)-3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]sulfonylpropanamide.
What is the SMILES notation for (2R)-N,N-dimethyl-2-[(3R)-3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]sulfonylpropanamide?
The canonical SMILES for (2R)-N,N-dimethyl-2-[(3R)-3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]sulfonylpropanamide is Cc1nc(C[C@H]2CCCN(S(=O)(=O)[C@H](C)C(=O)N(C)C)C2)no1.
What is the InChIKey of (2R)-N,N-dimethyl-2-[(3R)-3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]sulfonylpropanamide?
The InChIKey is AOTFWQKHASPZRJ-ZYHUDNBSSA-N. The full InChI is InChI=1S/C14H24N4O4S/c1-10(14(19)17(3)4)23(20,21)18-7-5-6-12(9-18)8-13-15-11(2)22-16-13/h10,12H,5-9H2,1-4H3/t10-,12-/m1/s1.
What are the key properties of (2R)-N,N-dimethyl-2-[(3R)-3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]sulfonylpropanamide?
(2R)-N,N-dimethyl-2-[(3R)-3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]sulfonylpropanamide has a molecular weight of 344.44 g/mol, XLogP of 0.44, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N,N-dimethyl-2-[(3R)-3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]sulfonylpropanamide is sourced from PubChem (CID 124829296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).