6-[(2R)-2-benzylpyrrolidin-1-yl]-4-morpholin-4-yl-1H-pyridin-2-one

C20H25N3O2 — CID 155884468

IUPAC6-[(2R)-2-benzylpyrrolidin-1-yl]-4-morpholin-4-yl-1H-pyridin-2-one
SMILESO=c1cc(N2CCOCC2)cc(N2CCC[C@@H]2Cc2ccccc2)[nH]1
InChIInChI=1S/C20H25N3O2/c24-20-15-18(22-9-11-25-12-10-22)14-19(21-20)23-8-4-7-17(23)13-16-5-2-1-3-6-16/h1-3,5-6,14-15,17H,4,7-13H2,(H,21,24)/t17-/m1/s1
InChIKeyNUUYFIBMHLLMSL-QGZVFWFLSA-N
MW339.44 g/mol
LogP2.42
Rot. Bonds4

About 6-[(2R)-2-benzylpyrrolidin-1-yl]-4-morpholin-4-yl-1H-pyridin-2-one

6-[(2R)-2-benzylpyrrolidin-1-yl]-4-morpholin-4-yl-1H-pyridin-2-one (PubChem CID 155884468) has the molecular formula C20H25N3O2 and a molecular weight of 339.44 g/mol. Its IUPAC name is 6-[(2R)-2-benzylpyrrolidin-1-yl]-4-morpholin-4-yl-1H-pyridin-2-one.

Molecular Properties

Compound Name6-[(2R)-2-benzylpyrrolidin-1-yl]-4-morpholin-4-yl-1H-pyridin-2-one
PubChem CID155884468
Molecular FormulaC20H25N3O2
Molecular Weight339.44 g/mol
Exact Mass339.19
IUPAC Name6-[(2R)-2-benzylpyrrolidin-1-yl]-4-morpholin-4-yl-1H-pyridin-2-one
SMILESO=c1cc(N2CCOCC2)cc(N2CCC[C@@H]2Cc2ccccc2)[nH]1
InChIInChI=1S/C20H25N3O2/c24-20-15-18(22-9-11-25-12-10-22)14-19(21-20)23-8-4-7-17(23)13-16-5-2-1-3-6-16/h1-3,5-6,14-15,17H,4,7-13H2,(H,21,24)/t17-/m1/s1
InChIKeyNUUYFIBMHLLMSL-QGZVFWFLSA-N
XLogP2.42
TPSA48.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.44
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-[(2R)-2-benzylpyrrolidin-1-yl]-4-morpholin-4-yl-1H-pyridin-2-one?
The IUPAC name of 6-[(2R)-2-benzylpyrrolidin-1-yl]-4-morpholin-4-yl-1H-pyridin-2-one (CID 155884468) is 6-[(2R)-2-benzylpyrrolidin-1-yl]-4-morpholin-4-yl-1H-pyridin-2-one.
What is the SMILES notation for 6-[(2R)-2-benzylpyrrolidin-1-yl]-4-morpholin-4-yl-1H-pyridin-2-one?
The canonical SMILES for 6-[(2R)-2-benzylpyrrolidin-1-yl]-4-morpholin-4-yl-1H-pyridin-2-one is O=c1cc(N2CCOCC2)cc(N2CCC[C@@H]2Cc2ccccc2)[nH]1.
What is the InChIKey of 6-[(2R)-2-benzylpyrrolidin-1-yl]-4-morpholin-4-yl-1H-pyridin-2-one?
The InChIKey is NUUYFIBMHLLMSL-QGZVFWFLSA-N. The full InChI is InChI=1S/C20H25N3O2/c24-20-15-18(22-9-11-25-12-10-22)14-19(21-20)23-8-4-7-17(23)13-16-5-2-1-3-6-16/h1-3,5-6,14-15,17H,4,7-13H2,(H,21,24)/t17-/m1/s1.
What are the key properties of 6-[(2R)-2-benzylpyrrolidin-1-yl]-4-morpholin-4-yl-1H-pyridin-2-one?
6-[(2R)-2-benzylpyrrolidin-1-yl]-4-morpholin-4-yl-1H-pyridin-2-one has a molecular weight of 339.44 g/mol, XLogP of 2.42, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(2R)-2-benzylpyrrolidin-1-yl]-4-morpholin-4-yl-1H-pyridin-2-one is sourced from PubChem (CID 155884468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).