(5S)-5-[3-[(2S)-2-ethylpiperidin-1-yl]-3-oxopropyl]-5-methylpyrrolidin-2-one

C15H26N2O2 — CID 26319382

IUPAC(5S)-5-[3-[(2S)-2-ethylpiperidin-1-yl]-3-oxopropyl]-5-methylpyrrolidin-2-one
SMILESCC[C@H]1CCCCN1C(=O)CC[C@]1(C)CCC(=O)N1
InChIInChI=1S/C15H26N2O2/c1-3-12-6-4-5-11-17(12)14(19)8-10-15(2)9-7-13(18)16-15/h12H,3-11H2,1-2H3,(H,16,18)/t12-,15-/m0/s1
InChIKeyMOONKNMRNRIKTE-WFASDCNBSA-N
MW266.38 g/mol
LogP2.23
Rot. Bonds4

About (5S)-5-[3-[(2S)-2-ethylpiperidin-1-yl]-3-oxopropyl]-5-methylpyrrolidin-2-one

(5S)-5-[3-[(2S)-2-ethylpiperidin-1-yl]-3-oxopropyl]-5-methylpyrrolidin-2-one (PubChem CID 26319382) has the molecular formula C15H26N2O2 and a molecular weight of 266.38 g/mol. Its IUPAC name is (5S)-5-[3-[(2S)-2-ethylpiperidin-1-yl]-3-oxopropyl]-5-methylpyrrolidin-2-one.

Molecular Properties

Compound Name(5S)-5-[3-[(2S)-2-ethylpiperidin-1-yl]-3-oxopropyl]-5-methylpyrrolidin-2-one
PubChem CID26319382
Molecular FormulaC15H26N2O2
Molecular Weight266.38 g/mol
Exact Mass266.20
IUPAC Name(5S)-5-[3-[(2S)-2-ethylpiperidin-1-yl]-3-oxopropyl]-5-methylpyrrolidin-2-one
SMILESCC[C@H]1CCCCN1C(=O)CC[C@]1(C)CCC(=O)N1
InChIInChI=1S/C15H26N2O2/c1-3-12-6-4-5-11-17(12)14(19)8-10-15(2)9-7-13(18)16-15/h12H,3-11H2,1-2H3,(H,16,18)/t12-,15-/m0/s1
InChIKeyMOONKNMRNRIKTE-WFASDCNBSA-N
XLogP2.23
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.38
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(5R)-5-[3-[(2R)-2-ethylpiperidin-1-yl]-3-oxopropyl]-5-methylpyrrolidin-2-one
CID 26319377
5-methyl-5-[3-[4-[3-(2-methyl-5-oxopyrrolidin-2-yl)propanoyl]-1,4-diazepan-1-yl]-3-oxopropyl]pyrrolidin-2-one
CID 166221552
1-(2-ethylpiperidin-1-yl)pentan-1-one
CID 3041221
1-[(2R)-2-ethylpiperidin-1-yl]propan-1-one
CID 40538705
1-(2-ethylazepan-1-yl)-3-methoxypropan-1-one
CID 167776443
4-(2-ethylazepan-1-yl)-4-oxobutanoic acid
CID 115910484
1-(2-ethylpiperidin-1-yl)-2-methylsulfanylethanone
CID 42891834
(3aR,7aS)-2-[3-[(2R)-2-ethylpiperidin-1-yl]-3-oxopropyl]-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione
CID 94337273
1-(2-ethylpyrrolidin-1-yl)butan-1-one
CID 63083979
3-cyclohexyl-1-[(2R)-2-ethylpiperidin-1-yl]propan-1-one
CID 890408
6-(2-ethylpiperidin-1-yl)-6-oxohexanoic acid
CID 43447225
4-chloro-1-(2-ethylpiperidin-1-yl)butan-1-one
CID 3613562

Frequently Asked Questions

What is the IUPAC name of (5S)-5-[3-[(2S)-2-ethylpiperidin-1-yl]-3-oxopropyl]-5-methylpyrrolidin-2-one?
The IUPAC name of (5S)-5-[3-[(2S)-2-ethylpiperidin-1-yl]-3-oxopropyl]-5-methylpyrrolidin-2-one (CID 26319382) is (5S)-5-[3-[(2S)-2-ethylpiperidin-1-yl]-3-oxopropyl]-5-methylpyrrolidin-2-one.
What is the SMILES notation for (5S)-5-[3-[(2S)-2-ethylpiperidin-1-yl]-3-oxopropyl]-5-methylpyrrolidin-2-one?
The canonical SMILES for (5S)-5-[3-[(2S)-2-ethylpiperidin-1-yl]-3-oxopropyl]-5-methylpyrrolidin-2-one is CC[C@H]1CCCCN1C(=O)CC[C@]1(C)CCC(=O)N1.
What is the InChIKey of (5S)-5-[3-[(2S)-2-ethylpiperidin-1-yl]-3-oxopropyl]-5-methylpyrrolidin-2-one?
The InChIKey is MOONKNMRNRIKTE-WFASDCNBSA-N. The full InChI is InChI=1S/C15H26N2O2/c1-3-12-6-4-5-11-17(12)14(19)8-10-15(2)9-7-13(18)16-15/h12H,3-11H2,1-2H3,(H,16,18)/t12-,15-/m0/s1.
What are the key properties of (5S)-5-[3-[(2S)-2-ethylpiperidin-1-yl]-3-oxopropyl]-5-methylpyrrolidin-2-one?
(5S)-5-[3-[(2S)-2-ethylpiperidin-1-yl]-3-oxopropyl]-5-methylpyrrolidin-2-one has a molecular weight of 266.38 g/mol, XLogP of 2.23, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5S)-5-[3-[(2S)-2-ethylpiperidin-1-yl]-3-oxopropyl]-5-methylpyrrolidin-2-one is sourced from PubChem (CID 26319382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).