[(2S)-1-[(1R)-cyclohex-2-en-1-yl]pyrrolidin-2-yl]-morpholin-4-ylmethanone

C15H24N2O2 — CID 100575845

IUPAC[(2S)-1-[(1R)-cyclohex-2-en-1-yl]pyrrolidin-2-yl]-morpholin-4-ylmethanone
SMILESO=C([C@@H]1CCCN1[C@H]1C=CCCC1)N1CCOCC1
InChIInChI=1S/C15H24N2O2/c18-15(16-9-11-19-12-10-16)14-7-4-8-17(14)13-5-2-1-3-6-13/h2,5,13-14H,1,3-4,6-12H2/t13-,14-/m0/s1
InChIKeyLZBUJNAIISDAGH-KBPBESRZSA-N
MW264.37 g/mol
LogP1.42
Rot. Bonds2

About [(2S)-1-[(1R)-cyclohex-2-en-1-yl]pyrrolidin-2-yl]-morpholin-4-ylmethanone

[(2S)-1-[(1R)-cyclohex-2-en-1-yl]pyrrolidin-2-yl]-morpholin-4-ylmethanone (PubChem CID 100575845) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is [(2S)-1-[(1R)-cyclohex-2-en-1-yl]pyrrolidin-2-yl]-morpholin-4-ylmethanone.

Molecular Properties

Compound Name[(2S)-1-[(1R)-cyclohex-2-en-1-yl]pyrrolidin-2-yl]-morpholin-4-ylmethanone
PubChem CID100575845
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name[(2S)-1-[(1R)-cyclohex-2-en-1-yl]pyrrolidin-2-yl]-morpholin-4-ylmethanone
SMILESO=C([C@@H]1CCCN1[C@H]1C=CCCC1)N1CCOCC1
InChIInChI=1S/C15H24N2O2/c18-15(16-9-11-19-12-10-16)14-7-4-8-17(14)13-5-2-1-3-6-13/h2,5,13-14H,1,3-4,6-12H2/t13-,14-/m0/s1
InChIKeyLZBUJNAIISDAGH-KBPBESRZSA-N
XLogP1.42
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

1-(2-Morpholin-4-ylethyl)-5-prop-2-enylpyrrolidin-2-one
CID 58550080
1-[2-(Morpholine-4-carbonyl)pyrrolidin-1-yl]prop-2-en-1-one
CID 54875251
2-(Cyclohexen-1-yl)-1-[2-(morpholine-4-carbonyl)pyrrolidin-1-yl]ethanone
CID 56788439
(1-Cyclohex-2-en-1-ylpyrrolidin-2-yl)-morpholin-4-ylmethanone
CID 56789979
1-[2-(Morpholine-4-carbonyl)pyrrolidin-1-yl]but-2-en-1-one
CID 78955805
[1-(4-Aminocyclopent-2-ene-1-carbonyl)pyrrolidin-2-yl]-morpholin-4-ylmethanone
CID 79209164
2-cyclohex-3-en-1-yl-6,7,8,8a-tetrahydro-3H-pyrrolo[1,2-a]pyrazine-1,4-dione
CID 79944163
2-Amino-1-[2-(morpholine-4-carbonyl)pyrrolidin-1-yl]pent-4-en-1-one
CID 81774996
2-(cyclohexen-1-yl)-1-[(2R)-2-(morpholine-4-carbonyl)pyrrolidin-1-yl]ethanone
CID 95623368
2-(cyclohexen-1-yl)-1-[(2S)-2-(morpholine-4-carbonyl)pyrrolidin-1-yl]ethanone
CID 95623369
[(2R)-1-[(1R)-cyclohex-2-en-1-yl]pyrrolidin-2-yl]-morpholin-4-ylmethanone
CID 95626134
[(2R)-1-[(1S)-cyclohex-2-en-1-yl]pyrrolidin-2-yl]-morpholin-4-ylmethanone
CID 95626135

Frequently Asked Questions

What is the IUPAC name of [(2S)-1-[(1R)-cyclohex-2-en-1-yl]pyrrolidin-2-yl]-morpholin-4-ylmethanone?
The IUPAC name of [(2S)-1-[(1R)-cyclohex-2-en-1-yl]pyrrolidin-2-yl]-morpholin-4-ylmethanone (CID 100575845) is [(2S)-1-[(1R)-cyclohex-2-en-1-yl]pyrrolidin-2-yl]-morpholin-4-ylmethanone.
What is the SMILES notation for [(2S)-1-[(1R)-cyclohex-2-en-1-yl]pyrrolidin-2-yl]-morpholin-4-ylmethanone?
The canonical SMILES for [(2S)-1-[(1R)-cyclohex-2-en-1-yl]pyrrolidin-2-yl]-morpholin-4-ylmethanone is O=C([C@@H]1CCCN1[C@H]1C=CCCC1)N1CCOCC1.
What is the InChIKey of [(2S)-1-[(1R)-cyclohex-2-en-1-yl]pyrrolidin-2-yl]-morpholin-4-ylmethanone?
The InChIKey is LZBUJNAIISDAGH-KBPBESRZSA-N. The full InChI is InChI=1S/C15H24N2O2/c18-15(16-9-11-19-12-10-16)14-7-4-8-17(14)13-5-2-1-3-6-13/h2,5,13-14H,1,3-4,6-12H2/t13-,14-/m0/s1.
What are the key properties of [(2S)-1-[(1R)-cyclohex-2-en-1-yl]pyrrolidin-2-yl]-morpholin-4-ylmethanone?
[(2S)-1-[(1R)-cyclohex-2-en-1-yl]pyrrolidin-2-yl]-morpholin-4-ylmethanone has a molecular weight of 264.37 g/mol, XLogP of 1.42, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(2S)-1-[(1R)-cyclohex-2-en-1-yl]pyrrolidin-2-yl]-morpholin-4-ylmethanone is sourced from PubChem (CID 100575845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).