(2R)-2-(4-methoxyphenyl)-N-methyl-2-[(2S)-2-(morpholine-4-carbonyl)pyrrolidin-1-yl]acetamide

C19H27N3O4 — CID 75411419

IUPAC(2R)-2-(4-methoxyphenyl)-N-methyl-2-[(2S)-2-(morpholine-4-carbonyl)pyrrolidin-1-yl]acetamide
SMILESCNC(=O)[C@@H](c1ccc(OC)cc1)N1CCC[C@H]1C(=O)N1CCOCC1
InChIInChI=1S/C19H27N3O4/c1-20-18(23)17(14-5-7-15(25-2)8-6-14)22-9-3-4-16(22)19(24)21-10-12-26-13-11-21/h5-8,16-17H,3-4,9-13H2,1-2H3,(H,20,23)/t16-,17+/m0/s1
InChIKeyGZOQHJSCUWHXNF-DLBZAZTESA-N
MW361.44 g/mol
LogP0.81
Rot. Bonds5

About (2R)-2-(4-methoxyphenyl)-N-methyl-2-[(2S)-2-(morpholine-4-carbonyl)pyrrolidin-1-yl]acetamide

(2R)-2-(4-methoxyphenyl)-N-methyl-2-[(2S)-2-(morpholine-4-carbonyl)pyrrolidin-1-yl]acetamide (PubChem CID 75411419) has the molecular formula C19H27N3O4 and a molecular weight of 361.44 g/mol. Its IUPAC name is (2R)-2-(4-methoxyphenyl)-N-methyl-2-[(2S)-2-(morpholine-4-carbonyl)pyrrolidin-1-yl]acetamide.

Molecular Properties

Compound Name(2R)-2-(4-methoxyphenyl)-N-methyl-2-[(2S)-2-(morpholine-4-carbonyl)pyrrolidin-1-yl]acetamide
PubChem CID75411419
Molecular FormulaC19H27N3O4
Molecular Weight361.44 g/mol
Exact Mass361.20
IUPAC Name(2R)-2-(4-methoxyphenyl)-N-methyl-2-[(2S)-2-(morpholine-4-carbonyl)pyrrolidin-1-yl]acetamide
SMILESCNC(=O)[C@@H](c1ccc(OC)cc1)N1CCC[C@H]1C(=O)N1CCOCC1
InChIInChI=1S/C19H27N3O4/c1-20-18(23)17(14-5-7-15(25-2)8-6-14)22-9-3-4-16(22)19(24)21-10-12-26-13-11-21/h5-8,16-17H,3-4,9-13H2,1-2H3,(H,20,23)/t16-,17+/m0/s1
InChIKeyGZOQHJSCUWHXNF-DLBZAZTESA-N
XLogP0.81
TPSA71.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.44
LogP ≤ 50.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(2S)-1-[(1R)-1-(4-methoxyphenyl)-2-(methylamino)-2-oxoethyl]-N-(oxan-4-yl)pyrrolidine-2-carboxamide;hydrochloride
CID 172884842
(2S)-N-tert-butyl-1-[(1R)-1-(4-methoxyphenyl)-2-(methylamino)-2-oxoethyl]pyrrolidine-2-carboxamide;hydrochloride
CID 172884841
(2R)-2-[(2S)-2-(azetidine-1-carbonyl)pyrrolidin-1-yl]-N-methyl-2-phenylacetamide;hydrochloride
CID 146119399
(2R)-2-cyclopropyl-N-methyl-2-[(2S)-2-(morpholine-4-carbonyl)pyrrolidin-1-yl]acetamide
CID 75529695
(2R)-2-[(2S)-2-(azetidine-1-carbonyl)pyrrolidin-1-yl]-2-(2-methoxyphenyl)-N-methylacetamide
CID 75411518
[1-[2-(4-methoxyphenyl)ethyl]piperidin-2-yl]-morpholin-4-ylmethanone
CID 136522970
(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ylacetamide
CID 92642329
(2S)-2-[(2S)-2-(4-methoxyphenyl)pyrrolidin-1-yl]-N-(methylcarbamoyl)-2-phenylacetamide
CID 51730149
(2S)-N-[(2-methoxyphenyl)methyl]-2-(morpholine-4-carbonyl)pyrrolidine-1-carboxamide
CID 119072836
3,3-bis(4-methoxyphenyl)-1-morpholin-4-ylpropan-1-one
CID 110673887
(2S)-N-(4-methoxyphenyl)-2-morpholin-4-yl-2-(4-nitrophenyl)acetamide
CID 7279087
N-[2-(4-tert-butylanilino)-1-(4-methoxyphenyl)-2-oxoethyl]-N-methylmorpholine-4-carboxamide
CID 121316815

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(4-methoxyphenyl)-N-methyl-2-[(2S)-2-(morpholine-4-carbonyl)pyrrolidin-1-yl]acetamide?
The IUPAC name of (2R)-2-(4-methoxyphenyl)-N-methyl-2-[(2S)-2-(morpholine-4-carbonyl)pyrrolidin-1-yl]acetamide (CID 75411419) is (2R)-2-(4-methoxyphenyl)-N-methyl-2-[(2S)-2-(morpholine-4-carbonyl)pyrrolidin-1-yl]acetamide.
What is the SMILES notation for (2R)-2-(4-methoxyphenyl)-N-methyl-2-[(2S)-2-(morpholine-4-carbonyl)pyrrolidin-1-yl]acetamide?
The canonical SMILES for (2R)-2-(4-methoxyphenyl)-N-methyl-2-[(2S)-2-(morpholine-4-carbonyl)pyrrolidin-1-yl]acetamide is CNC(=O)[C@@H](c1ccc(OC)cc1)N1CCC[C@H]1C(=O)N1CCOCC1.
What is the InChIKey of (2R)-2-(4-methoxyphenyl)-N-methyl-2-[(2S)-2-(morpholine-4-carbonyl)pyrrolidin-1-yl]acetamide?
The InChIKey is GZOQHJSCUWHXNF-DLBZAZTESA-N. The full InChI is InChI=1S/C19H27N3O4/c1-20-18(23)17(14-5-7-15(25-2)8-6-14)22-9-3-4-16(22)19(24)21-10-12-26-13-11-21/h5-8,16-17H,3-4,9-13H2,1-2H3,(H,20,23)/t16-,17+/m0/s1.
What are the key properties of (2R)-2-(4-methoxyphenyl)-N-methyl-2-[(2S)-2-(morpholine-4-carbonyl)pyrrolidin-1-yl]acetamide?
(2R)-2-(4-methoxyphenyl)-N-methyl-2-[(2S)-2-(morpholine-4-carbonyl)pyrrolidin-1-yl]acetamide has a molecular weight of 361.44 g/mol, XLogP of 0.81, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(4-methoxyphenyl)-N-methyl-2-[(2S)-2-(morpholine-4-carbonyl)pyrrolidin-1-yl]acetamide is sourced from PubChem (CID 75411419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).