4-hydroxy-N-methyl-N-(2-pyrrolidin-1-ylethyl)pyrrolidine-2-carboxamide

C12H23N3O2 — CID 63207272

IUPAC4-hydroxy-N-methyl-N-(2-pyrrolidin-1-ylethyl)pyrrolidine-2-carboxamide
SMILESCN(CCN1CCCC1)C(=O)C1CC(O)CN1
InChIInChI=1S/C12H23N3O2/c1-14(6-7-15-4-2-3-5-15)12(17)11-8-10(16)9-13-11/h10-11,13,16H,2-9H2,1H3
InChIKeyJUHJRNBAWWCGEG-UHFFFAOYSA-N
MW241.33 g/mol
LogP-0.74
Rot. Bonds4

About 4-hydroxy-N-methyl-N-(2-pyrrolidin-1-ylethyl)pyrrolidine-2-carboxamide

4-hydroxy-N-methyl-N-(2-pyrrolidin-1-ylethyl)pyrrolidine-2-carboxamide (PubChem CID 63207272) has the molecular formula C12H23N3O2 and a molecular weight of 241.33 g/mol. Its IUPAC name is 4-hydroxy-N-methyl-N-(2-pyrrolidin-1-ylethyl)pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name4-hydroxy-N-methyl-N-(2-pyrrolidin-1-ylethyl)pyrrolidine-2-carboxamide
PubChem CID63207272
Molecular FormulaC12H23N3O2
Molecular Weight241.33 g/mol
Exact Mass241.18
IUPAC Name4-hydroxy-N-methyl-N-(2-pyrrolidin-1-ylethyl)pyrrolidine-2-carboxamide
SMILESCN(CCN1CCCC1)C(=O)C1CC(O)CN1
InChIInChI=1S/C12H23N3O2/c1-14(6-7-15-4-2-3-5-15)12(17)11-8-10(16)9-13-11/h10-11,13,16H,2-9H2,1H3
InChIKeyJUHJRNBAWWCGEG-UHFFFAOYSA-N
XLogP-0.74
TPSA55.81 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 5-0.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-N-methyl-N-(2-pyrrolidin-1-ylethyl)piperidine-2-carboxamide
CID 95031613
N-methyl-5-oxo-N-(2-pyrrolidin-1-ylethyl)piperazine-2-carboxamide
CID 107436470
4-hydroxy-N,N-dimethylpyrrolidine-2-carboxamide
CID 19907192
(2R,4S)-N-(2,2-difluoroethyl)-4-hydroxy-N-methylpyrrolidine-2-carboxamide
CID 120553005
(2R,4S)-4-hydroxy-N-(2-piperidin-1-ylethyl)pyrrolidine-2-carboxamide
CID 94229368
4-hydroxy-N-[(1-hydroxycyclopentyl)methyl]-N-methylpyrrolidine-2-carboxamide
CID 114948997
N-hept-6-enyl-4-hydroxy-N-methylpyrrolidine-2-carboxamide
CID 77158348
(2R,4R)-4-hydroxy-N-methyl-N-(2-naphthalen-1-ylethyl)pyrrolidine-2-carboxamide
CID 124726613
N-[2-(azepan-1-yl)ethyl]-N-methyl-2,5-dihydro-1H-pyrrole-2-carboxamide
CID 122559026
N-[2-(azepan-1-yl)ethyl]-N-methyl-2,5-dihydro-1H-pyrrole-2-carboxamide;dihydrochloride
CID 154910983
(2R,4S)-4-hydroxy-N,N-dipropylpyrrolidine-2-carboxamide;hydrochloride
CID 120552956
(2S,4S)-4-hydroxy-N-methyl-N-(2-thiophen-2-ylethyl)pyrrolidine-2-carboxamide
CID 124516580

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-N-methyl-N-(2-pyrrolidin-1-ylethyl)pyrrolidine-2-carboxamide?
The IUPAC name of 4-hydroxy-N-methyl-N-(2-pyrrolidin-1-ylethyl)pyrrolidine-2-carboxamide (CID 63207272) is 4-hydroxy-N-methyl-N-(2-pyrrolidin-1-ylethyl)pyrrolidine-2-carboxamide.
What is the SMILES notation for 4-hydroxy-N-methyl-N-(2-pyrrolidin-1-ylethyl)pyrrolidine-2-carboxamide?
The canonical SMILES for 4-hydroxy-N-methyl-N-(2-pyrrolidin-1-ylethyl)pyrrolidine-2-carboxamide is CN(CCN1CCCC1)C(=O)C1CC(O)CN1.
What is the InChIKey of 4-hydroxy-N-methyl-N-(2-pyrrolidin-1-ylethyl)pyrrolidine-2-carboxamide?
The InChIKey is JUHJRNBAWWCGEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O2/c1-14(6-7-15-4-2-3-5-15)12(17)11-8-10(16)9-13-11/h10-11,13,16H,2-9H2,1H3.
What are the key properties of 4-hydroxy-N-methyl-N-(2-pyrrolidin-1-ylethyl)pyrrolidine-2-carboxamide?
4-hydroxy-N-methyl-N-(2-pyrrolidin-1-ylethyl)pyrrolidine-2-carboxamide has a molecular weight of 241.33 g/mol, XLogP of -0.74, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-N-methyl-N-(2-pyrrolidin-1-ylethyl)pyrrolidine-2-carboxamide is sourced from PubChem (CID 63207272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).