(4-aminooxolan-3-yl)-(2-methylpyrrolidin-1-yl)methanone

C10H18N2O2 — CID 66236454

IUPAC(4-aminooxolan-3-yl)-(2-methylpyrrolidin-1-yl)methanone
SMILESCC1CCCN1C(=O)C1COCC1N
InChIInChI=1S/C10H18N2O2/c1-7-3-2-4-12(7)10(13)8-5-14-6-9(8)11/h7-9H,2-6,11H2,1H3
InChIKeyOURKBOCUZMUCFV-UHFFFAOYSA-N
MW198.27 g/mol
LogP-0.03
Rot. Bonds1

About (4-aminooxolan-3-yl)-(2-methylpyrrolidin-1-yl)methanone

(4-aminooxolan-3-yl)-(2-methylpyrrolidin-1-yl)methanone (PubChem CID 66236454) has the molecular formula C10H18N2O2 and a molecular weight of 198.27 g/mol. Its IUPAC name is (4-aminooxolan-3-yl)-(2-methylpyrrolidin-1-yl)methanone.

Molecular Properties

Compound Name(4-aminooxolan-3-yl)-(2-methylpyrrolidin-1-yl)methanone
PubChem CID66236454
Molecular FormulaC10H18N2O2
Molecular Weight198.27 g/mol
Exact Mass198.14
IUPAC Name(4-aminooxolan-3-yl)-(2-methylpyrrolidin-1-yl)methanone
SMILESCC1CCCN1C(=O)C1COCC1N
InChIInChI=1S/C10H18N2O2/c1-7-3-2-4-12(7)10(13)8-5-14-6-9(8)11/h7-9H,2-6,11H2,1H3
InChIKeyOURKBOCUZMUCFV-UHFFFAOYSA-N
XLogP-0.03
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.27
LogP ≤ 5-0.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(4-aminooxolan-3-yl)-[(3R)-3-methylmorpholin-4-yl]methanone
CID 106774354
1-(4-aminooxolane-3-carbonyl)-N,N-dimethylpyrrolidine-2-carboxamide
CID 66240806
(4-aminooxolan-3-yl)-(2-cyclohexylpyrrolidin-1-yl)methanone
CID 66237049
(4-aminooxolan-3-yl)-(3-methylpiperidin-1-yl)methanone
CID 66239793
(2-aminocyclohexyl)-(2-methylpiperidin-1-yl)methanone
CID 62775944
(5-amino-2,4-dimethylcyclohexyl)-(2-methylpyrrolidin-1-yl)methanone
CID 102706440
(2-methylcyclopropyl)-(2-methylpyrrolidin-1-yl)methanone
CID 123276609
[4-(methylamino)oxolan-3-yl]-(2-methylazepan-1-yl)methanone
CID 66266661
(4-aminooxolan-3-yl)-[2-(3-methyl-1,2-oxazol-5-yl)pyrrolidin-1-yl]methanone
CID 66236852
(3S)-1-(4-aminooxolane-3-carbonyl)piperidine-3-carboxylic acid
CID 81126290
2-(2-methylpiperidine-1-carbonyl)cyclobutane-1-carboxylic acid
CID 120974339
4-(4-aminooxolane-3-carbonyl)-3-methylpiperazine-2,6-dione
CID 66237316

Frequently Asked Questions

What is the IUPAC name of (4-aminooxolan-3-yl)-(2-methylpyrrolidin-1-yl)methanone?
The IUPAC name of (4-aminooxolan-3-yl)-(2-methylpyrrolidin-1-yl)methanone (CID 66236454) is (4-aminooxolan-3-yl)-(2-methylpyrrolidin-1-yl)methanone.
What is the SMILES notation for (4-aminooxolan-3-yl)-(2-methylpyrrolidin-1-yl)methanone?
The canonical SMILES for (4-aminooxolan-3-yl)-(2-methylpyrrolidin-1-yl)methanone is CC1CCCN1C(=O)C1COCC1N.
What is the InChIKey of (4-aminooxolan-3-yl)-(2-methylpyrrolidin-1-yl)methanone?
The InChIKey is OURKBOCUZMUCFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O2/c1-7-3-2-4-12(7)10(13)8-5-14-6-9(8)11/h7-9H,2-6,11H2,1H3.
What are the key properties of (4-aminooxolan-3-yl)-(2-methylpyrrolidin-1-yl)methanone?
(4-aminooxolan-3-yl)-(2-methylpyrrolidin-1-yl)methanone has a molecular weight of 198.27 g/mol, XLogP of -0.03, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-aminooxolan-3-yl)-(2-methylpyrrolidin-1-yl)methanone is sourced from PubChem (CID 66236454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).