(4R)-1-[(2S)-1-methoxypropan-2-yl]-4-[(3R)-3-methylpiperidine-1-carbonyl]pyrrolidin-2-one

C15H26N2O3 — CID 9364887

IUPAC(4R)-1-[(2S)-1-methoxypropan-2-yl]-4-[(3R)-3-methylpiperidine-1-carbonyl]pyrrolidin-2-one
SMILESCOC[C@H](C)N1C[C@H](C(=O)N2CCC[C@@H](C)C2)CC1=O
InChIInChI=1S/C15H26N2O3/c1-11-5-4-6-16(8-11)15(19)13-7-14(18)17(9-13)12(2)10-20-3/h11-13H,4-10H2,1-3H3/t11-,12+,13-/m1/s1
InChIKeyKULDLKKOFXXDEQ-FRRDWIJNSA-N
MW282.38 g/mol
LogP1.13
Rot. Bonds4

About (4R)-1-[(2S)-1-methoxypropan-2-yl]-4-[(3R)-3-methylpiperidine-1-carbonyl]pyrrolidin-2-one

(4R)-1-[(2S)-1-methoxypropan-2-yl]-4-[(3R)-3-methylpiperidine-1-carbonyl]pyrrolidin-2-one (PubChem CID 9364887) has the molecular formula C15H26N2O3 and a molecular weight of 282.38 g/mol. Its IUPAC name is (4R)-1-[(2S)-1-methoxypropan-2-yl]-4-[(3R)-3-methylpiperidine-1-carbonyl]pyrrolidin-2-one.

Molecular Properties

Compound Name(4R)-1-[(2S)-1-methoxypropan-2-yl]-4-[(3R)-3-methylpiperidine-1-carbonyl]pyrrolidin-2-one
PubChem CID9364887
Molecular FormulaC15H26N2O3
Molecular Weight282.38 g/mol
Exact Mass282.19
IUPAC Name(4R)-1-[(2S)-1-methoxypropan-2-yl]-4-[(3R)-3-methylpiperidine-1-carbonyl]pyrrolidin-2-one
SMILESCOC[C@H](C)N1C[C@H](C(=O)N2CCC[C@@H](C)C2)CC1=O
InChIInChI=1S/C15H26N2O3/c1-11-5-4-6-16(8-11)15(19)13-7-14(18)17(9-13)12(2)10-20-3/h11-13H,4-10H2,1-3H3/t11-,12+,13-/m1/s1
InChIKeyKULDLKKOFXXDEQ-FRRDWIJNSA-N
XLogP1.13
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.38
LogP ≤ 51.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze (4R)-1-[(2S)-1-methoxypropan-2-yl]-4-[(3R)-3-methylpiperidine-1-carbonyl]pyrrolidin-2-one with MolForge

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Related Compounds

1-Cyclohexyl-4-(morpholin-4-ylcarbonyl)pyrrolidin-2-one
CID 2989312
1-Butyl-4-[(3,5-dimethyl-1-piperidinyl)carbonyl]-2-pyrrolidinone
CID 17082551
2-Isobutyryl-7-(2-methoxyethyl)-2,7-diazaspiro[4.5]decan-6-one
CID 45247653
1-Cyclopropyl-4-(3,5-dimethylpiperidine-1-carbonyl)pyrrolidin-2-one
CID 45843624
3-[3-(3-Methylpiperidin-1-yl)-3-oxopropyl]-1,3-oxazolidin-2-one
CID 47070741
4-[(4-Fluoropiperidin-1-yl)carbonyl]-1-(2-methoxyethyl)pyrrolidin-2-one
CID 131914555
1-Cyclopentyl-4-(morpholin-4-ylcarbonyl)pyrrolidin-2-one
CID 17081338
N-isopropyl-N-(2-methoxyethyl)-6-oxo-1-[3-(2-oxo-1-pyrrolidinyl)propyl]-3-piperidinecarboxamide
CID 45247393
1-Cycloheptyl-4-(morpholinocarbonyl)-2-pyrrolidinone
CID 53016012
3-(2-Ethyl-4-methylpyrrolidin-1-yl)-1-morpholin-4-ylpropan-1-one
CID 71867462
1-(2-Methyl-3-morpholin-4-ylpropyl)pyrrolidin-2-one
CID 10704448
Morpholin-4-yl-(1-propylpyrrolidin-3-yl)methanone
CID 59535649

Frequently Asked Questions

What is the IUPAC name of (4R)-1-[(2S)-1-methoxypropan-2-yl]-4-[(3R)-3-methylpiperidine-1-carbonyl]pyrrolidin-2-one?
The IUPAC name of (4R)-1-[(2S)-1-methoxypropan-2-yl]-4-[(3R)-3-methylpiperidine-1-carbonyl]pyrrolidin-2-one (CID 9364887) is (4R)-1-[(2S)-1-methoxypropan-2-yl]-4-[(3R)-3-methylpiperidine-1-carbonyl]pyrrolidin-2-one.
What is the SMILES notation for (4R)-1-[(2S)-1-methoxypropan-2-yl]-4-[(3R)-3-methylpiperidine-1-carbonyl]pyrrolidin-2-one?
The canonical SMILES for (4R)-1-[(2S)-1-methoxypropan-2-yl]-4-[(3R)-3-methylpiperidine-1-carbonyl]pyrrolidin-2-one is COC[C@H](C)N1C[C@H](C(=O)N2CCC[C@@H](C)C2)CC1=O.
What is the InChIKey of (4R)-1-[(2S)-1-methoxypropan-2-yl]-4-[(3R)-3-methylpiperidine-1-carbonyl]pyrrolidin-2-one?
The InChIKey is KULDLKKOFXXDEQ-FRRDWIJNSA-N. The full InChI is InChI=1S/C15H26N2O3/c1-11-5-4-6-16(8-11)15(19)13-7-14(18)17(9-13)12(2)10-20-3/h11-13H,4-10H2,1-3H3/t11-,12+,13-/m1/s1.
What are the key properties of (4R)-1-[(2S)-1-methoxypropan-2-yl]-4-[(3R)-3-methylpiperidine-1-carbonyl]pyrrolidin-2-one?
(4R)-1-[(2S)-1-methoxypropan-2-yl]-4-[(3R)-3-methylpiperidine-1-carbonyl]pyrrolidin-2-one has a molecular weight of 282.38 g/mol, XLogP of 1.13, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-1-[(2S)-1-methoxypropan-2-yl]-4-[(3R)-3-methylpiperidine-1-carbonyl]pyrrolidin-2-one is sourced from PubChem (CID 9364887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).