N-[2-(dimethylamino)-2-oxoethyl]-4-hydroxy-N-(2-methoxyethyl)pyrrolidine-2-carboxamide

C12H23N3O4 — CID 54871203

IUPACN-[2-(dimethylamino)-2-oxoethyl]-4-hydroxy-N-(2-methoxyethyl)pyrrolidine-2-carboxamide
SMILESCOCCN(CC(=O)N(C)C)C(=O)C1CC(O)CN1
InChIInChI=1S/C12H23N3O4/c1-14(2)11(17)8-15(4-5-19-3)12(18)10-6-9(16)7-13-10/h9-10,13,16H,4-8H2,1-3H3
InChIKeyAYGZMWNAWNQLIY-UHFFFAOYSA-N
MW273.33 g/mol
LogP-1.73
Rot. Bonds6

About N-[2-(dimethylamino)-2-oxoethyl]-4-hydroxy-N-(2-methoxyethyl)pyrrolidine-2-carboxamide

N-[2-(dimethylamino)-2-oxoethyl]-4-hydroxy-N-(2-methoxyethyl)pyrrolidine-2-carboxamide (PubChem CID 54871203) has the molecular formula C12H23N3O4 and a molecular weight of 273.33 g/mol. Its IUPAC name is N-[2-(dimethylamino)-2-oxoethyl]-4-hydroxy-N-(2-methoxyethyl)pyrrolidine-2-carboxamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)-2-oxoethyl]-4-hydroxy-N-(2-methoxyethyl)pyrrolidine-2-carboxamide
PubChem CID54871203
Molecular FormulaC12H23N3O4
Molecular Weight273.33 g/mol
Exact Mass273.17
IUPAC NameN-[2-(dimethylamino)-2-oxoethyl]-4-hydroxy-N-(2-methoxyethyl)pyrrolidine-2-carboxamide
SMILESCOCCN(CC(=O)N(C)C)C(=O)C1CC(O)CN1
InChIInChI=1S/C12H23N3O4/c1-14(2)11(17)8-15(4-5-19-3)12(18)10-6-9(16)7-13-10/h9-10,13,16H,4-8H2,1-3H3
InChIKeyAYGZMWNAWNQLIY-UHFFFAOYSA-N
XLogP-1.73
TPSA82.11 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.33
LogP ≤ 5-1.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-(dimethylamino)-2-oxoethyl]-N-ethyl-4-hydroxypyrrolidine-2-carboxamide
CID 43588844
4-hydroxy-N-(2-methoxyethyl)-N-propan-2-ylpyrrolidine-2-carboxamide
CID 82948394
methyl 2-[(4-hydroxypyrrolidine-2-carbonyl)-propylamino]acetate
CID 54871877
4-hydroxy-N,N-dimethylpyrrolidine-2-carboxamide
CID 19907192
(2R,4S)-4-hydroxy-N,N-dipropylpyrrolidine-2-carboxamide;hydrochloride
CID 120552956
N-(1,1-dioxothiolan-3-yl)-4-hydroxy-N-(2-methoxyethyl)pyrrolidine-2-carboxamide
CID 60937739
2-(2-methoxyethoxy)ethyl (2R,4R)-4-hydroxypyrrolidine-2-carboxylate
CID 104563509
N-[2-(dimethylamino)-2-oxoethyl]-4-hydroxypyrrolidine-2-carboxamide
CID 43310992
N-[2-(dimethylamino)-2-oxoethyl]-N-(2-methoxyethyl)prop-2-enamide
CID 60949543
N-(2-amino-2-oxoethyl)-4-hydroxy-N-(2-methylpropyl)pyrrolidine-2-carboxamide
CID 60963717
ethyl 2-[(4-hydroxypyrrolidine-2-carbonyl)-propan-2-ylamino]acetate
CID 54916695
(2R,4S)-N-(2,2-difluoroethyl)-4-hydroxy-N-methylpyrrolidine-2-carboxamide
CID 120553005

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)-2-oxoethyl]-4-hydroxy-N-(2-methoxyethyl)pyrrolidine-2-carboxamide?
The IUPAC name of N-[2-(dimethylamino)-2-oxoethyl]-4-hydroxy-N-(2-methoxyethyl)pyrrolidine-2-carboxamide (CID 54871203) is N-[2-(dimethylamino)-2-oxoethyl]-4-hydroxy-N-(2-methoxyethyl)pyrrolidine-2-carboxamide.
What is the SMILES notation for N-[2-(dimethylamino)-2-oxoethyl]-4-hydroxy-N-(2-methoxyethyl)pyrrolidine-2-carboxamide?
The canonical SMILES for N-[2-(dimethylamino)-2-oxoethyl]-4-hydroxy-N-(2-methoxyethyl)pyrrolidine-2-carboxamide is COCCN(CC(=O)N(C)C)C(=O)C1CC(O)CN1.
What is the InChIKey of N-[2-(dimethylamino)-2-oxoethyl]-4-hydroxy-N-(2-methoxyethyl)pyrrolidine-2-carboxamide?
The InChIKey is AYGZMWNAWNQLIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O4/c1-14(2)11(17)8-15(4-5-19-3)12(18)10-6-9(16)7-13-10/h9-10,13,16H,4-8H2,1-3H3.
What are the key properties of N-[2-(dimethylamino)-2-oxoethyl]-4-hydroxy-N-(2-methoxyethyl)pyrrolidine-2-carboxamide?
N-[2-(dimethylamino)-2-oxoethyl]-4-hydroxy-N-(2-methoxyethyl)pyrrolidine-2-carboxamide has a molecular weight of 273.33 g/mol, XLogP of -1.73, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)-2-oxoethyl]-4-hydroxy-N-(2-methoxyethyl)pyrrolidine-2-carboxamide is sourced from PubChem (CID 54871203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).