(2R)-N-[(2R)-1-methoxypropan-2-yl]-1-methylsulfonylpyrrolidine-2-carboxamide

C10H20N2O4S — CID 95129913

IUPAC(2R)-N-[(2R)-1-methoxypropan-2-yl]-1-methylsulfonylpyrrolidine-2-carboxamide
SMILESCOC[C@@H](C)NC(=O)[C@H]1CCCN1S(C)(=O)=O
InChIInChI=1S/C10H20N2O4S/c1-8(7-16-2)11-10(13)9-5-4-6-12(9)17(3,14)15/h8-9H,4-7H2,1-3H3,(H,11,13)/t8-,9-/m1/s1
InChIKeySLIQOEXWWZFMKA-RKDXNWHRSA-N
MW264.35 g/mol
LogP-0.44
Rot. Bonds5

About (2R)-N-[(2R)-1-methoxypropan-2-yl]-1-methylsulfonylpyrrolidine-2-carboxamide

(2R)-N-[(2R)-1-methoxypropan-2-yl]-1-methylsulfonylpyrrolidine-2-carboxamide (PubChem CID 95129913) has the molecular formula C10H20N2O4S and a molecular weight of 264.35 g/mol. Its IUPAC name is (2R)-N-[(2R)-1-methoxypropan-2-yl]-1-methylsulfonylpyrrolidine-2-carboxamide.

Molecular Properties

Compound Name(2R)-N-[(2R)-1-methoxypropan-2-yl]-1-methylsulfonylpyrrolidine-2-carboxamide
PubChem CID95129913
Molecular FormulaC10H20N2O4S
Molecular Weight264.35 g/mol
Exact Mass264.11
IUPAC Name(2R)-N-[(2R)-1-methoxypropan-2-yl]-1-methylsulfonylpyrrolidine-2-carboxamide
SMILESCOC[C@@H](C)NC(=O)[C@H]1CCCN1S(C)(=O)=O
InChIInChI=1S/C10H20N2O4S/c1-8(7-16-2)11-10(13)9-5-4-6-12(9)17(3,14)15/h8-9H,4-7H2,1-3H3,(H,11,13)/t8-,9-/m1/s1
InChIKeySLIQOEXWWZFMKA-RKDXNWHRSA-N
XLogP-0.44
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.35
LogP ≤ 5-0.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-methylsulfonyl-N-pentan-3-ylpyrrolidine-2-carboxamide
CID 134050674
1-methylsulfonyl-N-propan-2-yloxypyrrolidine-2-carboxamide
CID 154860289
1-methylsulfonyl-N-(4-phenylbutan-2-yl)pyrrolidine-2-carboxamide
CID 51240572
methyl 3-methyl-2-[(1-methylsulfonylpiperidine-2-carbonyl)amino]butanoate
CID 43423217
N-(1,3-dihydroxypropan-2-yl)-1-methylsulfonylpiperidine-2-carboxamide
CID 65309919
methyl 3-hydroxy-2-[(1-methylsulfonylpiperidine-2-carbonyl)amino]propanoate
CID 43423256
tert-butyl (2R)-2-[(1-methylsulfonylpyrrolidine-2-carbonyl)amino]propanoate
CID 81000032
N-(2-methylpropoxy)-1-methylsulfonylpiperidine-2-carboxamide
CID 115410256
(2R)-1-methylsulfonyl-N-[(2S)-4-morpholin-4-ylbutan-2-yl]piperidine-2-carboxamide
CID 95626517
N-(cyclopropylmethyl)-1-methylsulfonylpyrrolidine-2-carboxamide
CID 47158071
N-(3-methyl-2-propan-2-ylbutyl)-1-methylsulfonylpyrrolidine-2-carboxamide
CID 102915113
(2S)-N-(3-methoxypropyl)-1-methylsulfonylpiperidine-2-carboxamide
CID 94106905

Frequently Asked Questions

What is the IUPAC name of (2R)-N-[(2R)-1-methoxypropan-2-yl]-1-methylsulfonylpyrrolidine-2-carboxamide?
The IUPAC name of (2R)-N-[(2R)-1-methoxypropan-2-yl]-1-methylsulfonylpyrrolidine-2-carboxamide (CID 95129913) is (2R)-N-[(2R)-1-methoxypropan-2-yl]-1-methylsulfonylpyrrolidine-2-carboxamide.
What is the SMILES notation for (2R)-N-[(2R)-1-methoxypropan-2-yl]-1-methylsulfonylpyrrolidine-2-carboxamide?
The canonical SMILES for (2R)-N-[(2R)-1-methoxypropan-2-yl]-1-methylsulfonylpyrrolidine-2-carboxamide is COC[C@@H](C)NC(=O)[C@H]1CCCN1S(C)(=O)=O.
What is the InChIKey of (2R)-N-[(2R)-1-methoxypropan-2-yl]-1-methylsulfonylpyrrolidine-2-carboxamide?
The InChIKey is SLIQOEXWWZFMKA-RKDXNWHRSA-N. The full InChI is InChI=1S/C10H20N2O4S/c1-8(7-16-2)11-10(13)9-5-4-6-12(9)17(3,14)15/h8-9H,4-7H2,1-3H3,(H,11,13)/t8-,9-/m1/s1.
What are the key properties of (2R)-N-[(2R)-1-methoxypropan-2-yl]-1-methylsulfonylpyrrolidine-2-carboxamide?
(2R)-N-[(2R)-1-methoxypropan-2-yl]-1-methylsulfonylpyrrolidine-2-carboxamide has a molecular weight of 264.35 g/mol, XLogP of -0.44, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[(2R)-1-methoxypropan-2-yl]-1-methylsulfonylpyrrolidine-2-carboxamide is sourced from PubChem (CID 95129913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).