2-[(3R)-3-methoxypyrrolidin-1-yl]-4-methyl-1,3-oxazole

C9H14N2O2 — CID 130719650

IUPAC2-[(3R)-3-methoxypyrrolidin-1-yl]-4-methyl-1,3-oxazole
SMILESCO[C@@H]1CCN(c2nc(C)co2)C1
InChIInChI=1S/C9H14N2O2/c1-7-6-13-9(10-7)11-4-3-8(5-11)12-2/h6,8H,3-5H2,1-2H3/t8-/m1/s1
InChIKeyCRXSSZCQOKLSBG-MRVPVSSYSA-N
MW182.22 g/mol
LogP1.21
Rot. Bonds2

About 2-[(3R)-3-methoxypyrrolidin-1-yl]-4-methyl-1,3-oxazole

2-[(3R)-3-methoxypyrrolidin-1-yl]-4-methyl-1,3-oxazole (PubChem CID 130719650) has the molecular formula C9H14N2O2 and a molecular weight of 182.22 g/mol. Its IUPAC name is 2-[(3R)-3-methoxypyrrolidin-1-yl]-4-methyl-1,3-oxazole.

Molecular Properties

Compound Name2-[(3R)-3-methoxypyrrolidin-1-yl]-4-methyl-1,3-oxazole
PubChem CID130719650
Molecular FormulaC9H14N2O2
Molecular Weight182.22 g/mol
Exact Mass182.11
IUPAC Name2-[(3R)-3-methoxypyrrolidin-1-yl]-4-methyl-1,3-oxazole
SMILESCO[C@@H]1CCN(c2nc(C)co2)C1
InChIInChI=1S/C9H14N2O2/c1-7-6-13-9(10-7)11-4-3-8(5-11)12-2/h6,8H,3-5H2,1-2H3/t8-/m1/s1
InChIKeyCRXSSZCQOKLSBG-MRVPVSSYSA-N
XLogP1.21
TPSA38.50 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.22
LogP ≤ 51.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[2-(3-methoxypyrrolidin-1-yl)-1,3-oxazol-4-yl]methyl]ethanamine
CID 103539392
1-(4-methyl-1,3-oxazol-2-yl)azepan-4-amine
CID 83484644
5-(3-methoxypyrrolidin-1-yl)-1,3,4-oxadiazol-2-amine
CID 103542519
N'-hydroxy-4-(3-methoxypyrrolidin-1-yl)-2,6-dimethylpyridine-3-carboximidamide
CID 103533946
2-[(3S)-3-methoxypyrrolidin-1-yl]-N,6-dimethylpyridin-4-amine
CID 154661534
4-chloro-6-(3-methoxypyrrolidin-1-yl)-2-methylpyrimidine
CID 108773094
2-(3-methoxypyrrolidin-1-yl)-4,6-dimethylpyridine-3-carboxylic acid
CID 103534314
6-(3-methoxypyrrolidin-1-yl)-N,2-dimethylpyrimidin-4-amine
CID 103541803
2,3,5,6-tetrafluoro-4-(3-methoxypyrrolidin-1-yl)pyridine
CID 103536626
2-(3-methoxypyrrolidin-1-yl)-1,3-thiazol-4-amine
CID 102547220
2-[(3S)-3-methoxypyrrolidin-1-yl]-3-methylpyridine
CID 143449306
6-(3-methoxypyrrolidin-1-yl)pyrazin-2-amine
CID 103541702

Frequently Asked Questions

What is the IUPAC name of 2-[(3R)-3-methoxypyrrolidin-1-yl]-4-methyl-1,3-oxazole?
The IUPAC name of 2-[(3R)-3-methoxypyrrolidin-1-yl]-4-methyl-1,3-oxazole (CID 130719650) is 2-[(3R)-3-methoxypyrrolidin-1-yl]-4-methyl-1,3-oxazole.
What is the SMILES notation for 2-[(3R)-3-methoxypyrrolidin-1-yl]-4-methyl-1,3-oxazole?
The canonical SMILES for 2-[(3R)-3-methoxypyrrolidin-1-yl]-4-methyl-1,3-oxazole is CO[C@@H]1CCN(c2nc(C)co2)C1.
What is the InChIKey of 2-[(3R)-3-methoxypyrrolidin-1-yl]-4-methyl-1,3-oxazole?
The InChIKey is CRXSSZCQOKLSBG-MRVPVSSYSA-N. The full InChI is InChI=1S/C9H14N2O2/c1-7-6-13-9(10-7)11-4-3-8(5-11)12-2/h6,8H,3-5H2,1-2H3/t8-/m1/s1.
What are the key properties of 2-[(3R)-3-methoxypyrrolidin-1-yl]-4-methyl-1,3-oxazole?
2-[(3R)-3-methoxypyrrolidin-1-yl]-4-methyl-1,3-oxazole has a molecular weight of 182.22 g/mol, XLogP of 1.21, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3R)-3-methoxypyrrolidin-1-yl]-4-methyl-1,3-oxazole is sourced from PubChem (CID 130719650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).