(2R)-N-[2-(2-hydroxyethoxy)ethyl]pyrrolidine-2-carboxamide

C9H18N2O3 — CID 104901055

IUPAC(2R)-N-[2-(2-hydroxyethoxy)ethyl]pyrrolidine-2-carboxamide
SMILESO=C(NCCOCCO)[C@H]1CCCN1
InChIInChI=1S/C9H18N2O3/c12-5-7-14-6-4-11-9(13)8-2-1-3-10-8/h8,10,12H,1-7H2,(H,11,13)/t8-/m1/s1
InChIKeyISTZSCAYGSBQSD-MRVPVSSYSA-N
MW202.25 g/mol
LogP-1.14
Rot. Bonds6

About (2R)-N-[2-(2-hydroxyethoxy)ethyl]pyrrolidine-2-carboxamide

(2R)-N-[2-(2-hydroxyethoxy)ethyl]pyrrolidine-2-carboxamide (PubChem CID 104901055) has the molecular formula C9H18N2O3 and a molecular weight of 202.25 g/mol. Its IUPAC name is (2R)-N-[2-(2-hydroxyethoxy)ethyl]pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name(2R)-N-[2-(2-hydroxyethoxy)ethyl]pyrrolidine-2-carboxamide
PubChem CID104901055
Molecular FormulaC9H18N2O3
Molecular Weight202.25 g/mol
Exact Mass202.13
IUPAC Name(2R)-N-[2-(2-hydroxyethoxy)ethyl]pyrrolidine-2-carboxamide
SMILESO=C(NCCOCCO)[C@H]1CCCN1
InChIInChI=1S/C9H18N2O3/c12-5-7-14-6-4-11-9(13)8-2-1-3-10-8/h8,10,12H,1-7H2,(H,11,13)/t8-/m1/s1
InChIKeyISTZSCAYGSBQSD-MRVPVSSYSA-N
XLogP-1.14
TPSA70.59 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.25
LogP ≤ 5-1.14
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(2-ethoxyethyl)pyrrolidine-2-carboxamide
CID 43591374
N-(2-ethoxyethyl)piperidine-2-carboxamide;hydrochloride
CID 119280657
N-[2-(2-hydroxyethoxy)ethyl]thiomorpholine-3-carboxamide
CID 82908917
N-[4-(2-methoxyethoxy)butyl]pyrrolidine-2-carboxamide
CID 115626529
N-propylpyrrolidine-2-carboxamide
CID 4984185
(2S)-N-[2-(2-methoxyethylamino)-2-oxoethyl]pyrrolidine-2-carboxamide;hydrochloride
CID 119274176
(2S)-N-[2-[2-[[(2S)-pyrrolidine-2-carbonyl]amino]ethyldisulfanyl]ethyl]pyrrolidine-2-carboxamide
CID 11725207
N-(4-hydroxybutyl)azepane-2-carboxamide
CID 106842137
(2R)-N-[3-(methylamino)-3-oxopropyl]pyrrolidine-2-carboxamide
CID 103795515
(2R)-N-(2-cyclohexyloxyethyl)piperidine-2-carboxamide;hydrochloride
CID 119746139
N-[2-(3-hydroxypropylsulfanyl)ethyl]pyrrolidine-2-carboxamide
CID 103950540
(2S)-N-butylpyrrolidine-2-carboxamide
CID 22691332

Frequently Asked Questions

What is the IUPAC name of (2R)-N-[2-(2-hydroxyethoxy)ethyl]pyrrolidine-2-carboxamide?
The IUPAC name of (2R)-N-[2-(2-hydroxyethoxy)ethyl]pyrrolidine-2-carboxamide (CID 104901055) is (2R)-N-[2-(2-hydroxyethoxy)ethyl]pyrrolidine-2-carboxamide.
What is the SMILES notation for (2R)-N-[2-(2-hydroxyethoxy)ethyl]pyrrolidine-2-carboxamide?
The canonical SMILES for (2R)-N-[2-(2-hydroxyethoxy)ethyl]pyrrolidine-2-carboxamide is O=C(NCCOCCO)[C@H]1CCCN1.
What is the InChIKey of (2R)-N-[2-(2-hydroxyethoxy)ethyl]pyrrolidine-2-carboxamide?
The InChIKey is ISTZSCAYGSBQSD-MRVPVSSYSA-N. The full InChI is InChI=1S/C9H18N2O3/c12-5-7-14-6-4-11-9(13)8-2-1-3-10-8/h8,10,12H,1-7H2,(H,11,13)/t8-/m1/s1.
What are the key properties of (2R)-N-[2-(2-hydroxyethoxy)ethyl]pyrrolidine-2-carboxamide?
(2R)-N-[2-(2-hydroxyethoxy)ethyl]pyrrolidine-2-carboxamide has a molecular weight of 202.25 g/mol, XLogP of -1.14, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[2-(2-hydroxyethoxy)ethyl]pyrrolidine-2-carboxamide is sourced from PubChem (CID 104901055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).