4-morpholin-4-yl-6-[(2S)-2-phenylpyrrolidin-1-yl]piperidin-2-one

C19H27N3O2 — CID 163199989

IUPAC4-morpholin-4-yl-6-[(2S)-2-phenylpyrrolidin-1-yl]piperidin-2-one
SMILESO=C1CC(N2CCOCC2)CC(N2CCC[C@H]2c2ccccc2)N1
InChIInChI=1S/C19H27N3O2/c23-19-14-16(21-9-11-24-12-10-21)13-18(20-19)22-8-4-7-17(22)15-5-2-1-3-6-15/h1-3,5-6,16-18H,4,7-14H2,(H,20,23)/t16?,17-,18?/m0/s1
InChIKeyNOHBSPCZTXWXCV-ADKAHSJRSA-N
MW329.44 g/mol
LogP1.76
Rot. Bonds3

About 4-morpholin-4-yl-6-[(2S)-2-phenylpyrrolidin-1-yl]piperidin-2-one

4-morpholin-4-yl-6-[(2S)-2-phenylpyrrolidin-1-yl]piperidin-2-one (PubChem CID 163199989) has the molecular formula C19H27N3O2 and a molecular weight of 329.44 g/mol. Its IUPAC name is 4-morpholin-4-yl-6-[(2S)-2-phenylpyrrolidin-1-yl]piperidin-2-one.

Molecular Properties

Compound Name4-morpholin-4-yl-6-[(2S)-2-phenylpyrrolidin-1-yl]piperidin-2-one
PubChem CID163199989
Molecular FormulaC19H27N3O2
Molecular Weight329.44 g/mol
Exact Mass329.21
IUPAC Name4-morpholin-4-yl-6-[(2S)-2-phenylpyrrolidin-1-yl]piperidin-2-one
SMILESO=C1CC(N2CCOCC2)CC(N2CCC[C@H]2c2ccccc2)N1
InChIInChI=1S/C19H27N3O2/c23-19-14-16(21-9-11-24-12-10-21)13-18(20-19)22-8-4-7-17(22)15-5-2-1-3-6-15/h1-3,5-6,16-18H,4,7-14H2,(H,20,23)/t16?,17-,18?/m0/s1
InChIKeyNOHBSPCZTXWXCV-ADKAHSJRSA-N
XLogP1.76
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.44
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(diphenylmethyl)morpholin-4-ylcarboxamide
CID 1538456
N-(1-phenylethyl)morpholine-4-carboxamide
CID 3136314
N-[1-(Morpholine-4-carbonyl)-piperidin-4-yl]-benzamide
CID 645007
2-Methyl-N-[1-(morpholine-4-carbonyl)-piperidin-4-yl]-benzamide
CID 3218480
(S)-5-Benzyl-3-(2-morpholin-4-yl-ethyl)-imidazolidine-2,4-dione
CID 6577948
1-morpholin-4-ylsulfonyl-N-(1-phenylethyl)piperidine-3-carboxamide
CID 22552753
1-N-benzyl-4-N-(oxan-4-yl)piperidine-1,4-dicarboxamide
CID 70686704
3-benzyl-6-pentyldihydropyrimidine-2,4(1H,3H)-dione
CID 3241737
N-[7-[benzyl(3-morpholin-4-ylpropyl)amino]-7-oxoheptyl]-1,3-dihydroisoindole-2-carboxamide
CID 57510389
US11179399, Example 13
CID 163200003
US11179399, Example 13_1
CID 163200004
US11179399, Example 13_2
CID 163200005

Frequently Asked Questions

What is the IUPAC name of 4-morpholin-4-yl-6-[(2S)-2-phenylpyrrolidin-1-yl]piperidin-2-one?
The IUPAC name of 4-morpholin-4-yl-6-[(2S)-2-phenylpyrrolidin-1-yl]piperidin-2-one (CID 163199989) is 4-morpholin-4-yl-6-[(2S)-2-phenylpyrrolidin-1-yl]piperidin-2-one.
What is the SMILES notation for 4-morpholin-4-yl-6-[(2S)-2-phenylpyrrolidin-1-yl]piperidin-2-one?
The canonical SMILES for 4-morpholin-4-yl-6-[(2S)-2-phenylpyrrolidin-1-yl]piperidin-2-one is O=C1CC(N2CCOCC2)CC(N2CCC[C@H]2c2ccccc2)N1.
What is the InChIKey of 4-morpholin-4-yl-6-[(2S)-2-phenylpyrrolidin-1-yl]piperidin-2-one?
The InChIKey is NOHBSPCZTXWXCV-ADKAHSJRSA-N. The full InChI is InChI=1S/C19H27N3O2/c23-19-14-16(21-9-11-24-12-10-21)13-18(20-19)22-8-4-7-17(22)15-5-2-1-3-6-15/h1-3,5-6,16-18H,4,7-14H2,(H,20,23)/t16?,17-,18?/m0/s1.
What are the key properties of 4-morpholin-4-yl-6-[(2S)-2-phenylpyrrolidin-1-yl]piperidin-2-one?
4-morpholin-4-yl-6-[(2S)-2-phenylpyrrolidin-1-yl]piperidin-2-one has a molecular weight of 329.44 g/mol, XLogP of 1.76, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-morpholin-4-yl-6-[(2S)-2-phenylpyrrolidin-1-yl]piperidin-2-one is sourced from PubChem (CID 163199989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).