(2R,3S)-2-methyl-N-(1-methyl-5-oxopyrrolidin-3-yl)morpholine-3-carboxamide

C11H19N3O3 — CID 120928847

IUPAC(2R,3S)-2-methyl-N-(1-methyl-5-oxopyrrolidin-3-yl)morpholine-3-carboxamide
SMILESC[C@H]1OCCN[C@@H]1C(=O)NC1CC(=O)N(C)C1
InChIInChI=1S/C11H19N3O3/c1-7-10(12-3-4-17-7)11(16)13-8-5-9(15)14(2)6-8/h7-8,10,12H,3-6H2,1-2H3,(H,13,16)/t7-,8?,10+/m1/s1
InChIKeyBBDWRXKSJCDQRA-SHTILUHOSA-N
MW241.29 g/mol
LogP-1.29
Rot. Bonds2

About (2R,3S)-2-methyl-N-(1-methyl-5-oxopyrrolidin-3-yl)morpholine-3-carboxamide

(2R,3S)-2-methyl-N-(1-methyl-5-oxopyrrolidin-3-yl)morpholine-3-carboxamide (PubChem CID 120928847) has the molecular formula C11H19N3O3 and a molecular weight of 241.29 g/mol. Its IUPAC name is (2R,3S)-2-methyl-N-(1-methyl-5-oxopyrrolidin-3-yl)morpholine-3-carboxamide.

Molecular Properties

Compound Name(2R,3S)-2-methyl-N-(1-methyl-5-oxopyrrolidin-3-yl)morpholine-3-carboxamide
PubChem CID120928847
Molecular FormulaC11H19N3O3
Molecular Weight241.29 g/mol
Exact Mass241.14
IUPAC Name(2R,3S)-2-methyl-N-(1-methyl-5-oxopyrrolidin-3-yl)morpholine-3-carboxamide
SMILESC[C@H]1OCCN[C@@H]1C(=O)NC1CC(=O)N(C)C1
InChIInChI=1S/C11H19N3O3/c1-7-10(12-3-4-17-7)11(16)13-8-5-9(15)14(2)6-8/h7-8,10,12H,3-6H2,1-2H3,(H,13,16)/t7-,8?,10+/m1/s1
InChIKeyBBDWRXKSJCDQRA-SHTILUHOSA-N
XLogP-1.29
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 5-1.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2R,3S)-2-methyl-N-(5-oxo-1-propan-2-ylpyrrolidin-3-yl)morpholine-3-carboxamide;hydrochloride
CID 120930374
(2R,3S)-N-(1-cyclohexyl-5-oxopyrrolidin-3-yl)-2-methylmorpholine-3-carboxamide;hydrochloride
CID 120937589
(2R,3S)-N-[1-(3-methoxyphenyl)-5-oxopyrrolidin-3-yl]-2-methylmorpholine-3-carboxamide
CID 120930289
(2R,3S)-N-cyclopentyl-2-methylmorpholine-3-carboxamide;hydrochloride
CID 120917508
(2R,3S)-2-methyl-N-(3-methylcyclobutyl)morpholine-3-carboxamide;hydrochloride
CID 120933471
(2R,3S)-2-methyl-N-(thian-4-yl)morpholine-3-carboxamide
CID 120929940
(2S,4S)-2-methyl-N-(1-methyl-5-oxopyrrolidin-3-yl)piperidine-4-carboxamide
CID 120627814
(2R,3S)-2-methyl-N-[1-(1-methylpiperidin-4-yl)piperidin-4-yl]morpholine-3-carboxamide
CID 120940415
N,2-dimethylmorpholine-3-carboxamide
CID 131024914
(2R,3S)-2-methyl-N-(2-oxoazepan-3-yl)morpholine-3-carboxamide;hydrochloride
CID 120922098
(2R,3S)-N-[1-(2-methoxyethyl)piperidin-4-yl]-2-methylmorpholine-3-carboxamide
CID 120939904
(2R,3S)-2-methyl-N-(2,2,3,3-tetramethylcyclopropyl)morpholine-3-carboxamide;hydrochloride
CID 120937079

Frequently Asked Questions

What is the IUPAC name of (2R,3S)-2-methyl-N-(1-methyl-5-oxopyrrolidin-3-yl)morpholine-3-carboxamide?
The IUPAC name of (2R,3S)-2-methyl-N-(1-methyl-5-oxopyrrolidin-3-yl)morpholine-3-carboxamide (CID 120928847) is (2R,3S)-2-methyl-N-(1-methyl-5-oxopyrrolidin-3-yl)morpholine-3-carboxamide.
What is the SMILES notation for (2R,3S)-2-methyl-N-(1-methyl-5-oxopyrrolidin-3-yl)morpholine-3-carboxamide?
The canonical SMILES for (2R,3S)-2-methyl-N-(1-methyl-5-oxopyrrolidin-3-yl)morpholine-3-carboxamide is C[C@H]1OCCN[C@@H]1C(=O)NC1CC(=O)N(C)C1.
What is the InChIKey of (2R,3S)-2-methyl-N-(1-methyl-5-oxopyrrolidin-3-yl)morpholine-3-carboxamide?
The InChIKey is BBDWRXKSJCDQRA-SHTILUHOSA-N. The full InChI is InChI=1S/C11H19N3O3/c1-7-10(12-3-4-17-7)11(16)13-8-5-9(15)14(2)6-8/h7-8,10,12H,3-6H2,1-2H3,(H,13,16)/t7-,8?,10+/m1/s1.
What are the key properties of (2R,3S)-2-methyl-N-(1-methyl-5-oxopyrrolidin-3-yl)morpholine-3-carboxamide?
(2R,3S)-2-methyl-N-(1-methyl-5-oxopyrrolidin-3-yl)morpholine-3-carboxamide has a molecular weight of 241.29 g/mol, XLogP of -1.29, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3S)-2-methyl-N-(1-methyl-5-oxopyrrolidin-3-yl)morpholine-3-carboxamide is sourced from PubChem (CID 120928847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).