N,N-bis(2-hydroxyethyl)-5-oxopyrrolidine-3-carboxamide

C9H16N2O4 — CID 83191607

IUPACN,N-bis(2-hydroxyethyl)-5-oxopyrrolidine-3-carboxamide
SMILESO=C1CC(C(=O)N(CCO)CCO)CN1
InChIInChI=1S/C9H16N2O4/c12-3-1-11(2-4-13)9(15)7-5-8(14)10-6-7/h7,12-13H,1-6H2,(H,10,14)
InChIKeyZLBODIPHKWMZNR-UHFFFAOYSA-N
MW216.24 g/mol
LogP-2.06
Rot. Bonds5

About N,N-bis(2-hydroxyethyl)-5-oxopyrrolidine-3-carboxamide

N,N-bis(2-hydroxyethyl)-5-oxopyrrolidine-3-carboxamide (PubChem CID 83191607) has the molecular formula C9H16N2O4 and a molecular weight of 216.24 g/mol. Its IUPAC name is N,N-bis(2-hydroxyethyl)-5-oxopyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN,N-bis(2-hydroxyethyl)-5-oxopyrrolidine-3-carboxamide
PubChem CID83191607
Molecular FormulaC9H16N2O4
Molecular Weight216.24 g/mol
Exact Mass216.11
IUPAC NameN,N-bis(2-hydroxyethyl)-5-oxopyrrolidine-3-carboxamide
SMILESO=C1CC(C(=O)N(CCO)CCO)CN1
InChIInChI=1S/C9H16N2O4/c12-3-1-11(2-4-13)9(15)7-5-8(14)10-6-7/h7,12-13H,1-6H2,(H,10,14)
InChIKeyZLBODIPHKWMZNR-UHFFFAOYSA-N
XLogP-2.06
TPSA89.87 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.24
LogP ≤ 5-2.06
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-hydroxyethyl)-N-(2-methoxyethyl)-5-oxopyrrolidine-3-carboxamide
CID 115902348
N-[2-(dimethylamino)-2-oxoethyl]-5-oxo-N-propylpyrrolidine-3-carboxamide
CID 78982846
N-ethyl-N-(2-methylpropyl)-5-oxopyrrolidine-3-carboxamide
CID 78981630
N-(2-amino-2-oxoethyl)-N-ethyl-5-oxopyrrolidine-3-carboxamide
CID 103103793
1-N,1-N,4-N,4-N-tetrakis(2-hydroxyethyl)cyclohexane-1,4-dicarboxamide
CID 58434361
methyl 3-[2-methylpropyl-(5-oxopyrrolidine-3-carbonyl)amino]propanoate
CID 78981696
3-[tert-butyl-(5-oxopyrrolidine-3-carbonyl)amino]propanoic acid
CID 83191685
N-cyclopropyl-N-methyl-5-oxopyrrolidine-3-carboxamide
CID 78983294
N-[2-(dimethylamino)-2-oxoethyl]-5-oxo-N-(2,2,2-trifluoroethyl)pyrrolidine-3-carboxamide
CID 78981901
N-ethyl-N-(2-hydroxyethyl)-5-oxopiperazine-2-carboxamide
CID 107435117
N-[[1-(hydroxymethyl)cyclopropyl]methyl]-N-methyl-5-oxopyrrolidine-3-carboxamide
CID 136534386
(2S,5R)-2-N,2-N,5-N,5-N-tetrakis(2-hydroxyethyl)piperazine-2,5-dicarboxamide
CID 132520855

Frequently Asked Questions

What is the IUPAC name of N,N-bis(2-hydroxyethyl)-5-oxopyrrolidine-3-carboxamide?
The IUPAC name of N,N-bis(2-hydroxyethyl)-5-oxopyrrolidine-3-carboxamide (CID 83191607) is N,N-bis(2-hydroxyethyl)-5-oxopyrrolidine-3-carboxamide.
What is the SMILES notation for N,N-bis(2-hydroxyethyl)-5-oxopyrrolidine-3-carboxamide?
The canonical SMILES for N,N-bis(2-hydroxyethyl)-5-oxopyrrolidine-3-carboxamide is O=C1CC(C(=O)N(CCO)CCO)CN1.
What is the InChIKey of N,N-bis(2-hydroxyethyl)-5-oxopyrrolidine-3-carboxamide?
The InChIKey is ZLBODIPHKWMZNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2O4/c12-3-1-11(2-4-13)9(15)7-5-8(14)10-6-7/h7,12-13H,1-6H2,(H,10,14).
What are the key properties of N,N-bis(2-hydroxyethyl)-5-oxopyrrolidine-3-carboxamide?
N,N-bis(2-hydroxyethyl)-5-oxopyrrolidine-3-carboxamide has a molecular weight of 216.24 g/mol, XLogP of -2.06, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis(2-hydroxyethyl)-5-oxopyrrolidine-3-carboxamide is sourced from PubChem (CID 83191607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).