N-[(3-methoxyoxolan-3-yl)methyl]-2-pyrrolidin-2-ylacetamide

C12H22N2O3 — CID 113450280

IUPACN-[(3-methoxyoxolan-3-yl)methyl]-2-pyrrolidin-2-ylacetamide
SMILESCOC1(CNC(=O)CC2CCCN2)CCOC1
InChIInChI=1S/C12H22N2O3/c1-16-12(4-6-17-9-12)8-14-11(15)7-10-3-2-5-13-10/h10,13H,2-9H2,1H3,(H,14,15)
InChIKeyFZRBIZFBRWRYHS-UHFFFAOYSA-N
MW242.32 g/mol
LogP0.05
Rot. Bonds5

About N-[(3-methoxyoxolan-3-yl)methyl]-2-pyrrolidin-2-ylacetamide

N-[(3-methoxyoxolan-3-yl)methyl]-2-pyrrolidin-2-ylacetamide (PubChem CID 113450280) has the molecular formula C12H22N2O3 and a molecular weight of 242.32 g/mol. Its IUPAC name is N-[(3-methoxyoxolan-3-yl)methyl]-2-pyrrolidin-2-ylacetamide.

Molecular Properties

Compound NameN-[(3-methoxyoxolan-3-yl)methyl]-2-pyrrolidin-2-ylacetamide
PubChem CID113450280
Molecular FormulaC12H22N2O3
Molecular Weight242.32 g/mol
Exact Mass242.16
IUPAC NameN-[(3-methoxyoxolan-3-yl)methyl]-2-pyrrolidin-2-ylacetamide
SMILESCOC1(CNC(=O)CC2CCCN2)CCOC1
InChIInChI=1S/C12H22N2O3/c1-16-12(4-6-17-9-12)8-14-11(15)7-10-3-2-5-13-10/h10,13H,2-9H2,1H3,(H,14,15)
InChIKeyFZRBIZFBRWRYHS-UHFFFAOYSA-N
XLogP0.05
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 50.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(3-methoxyoxolan-3-yl)methyl]-2-methylpiperidine-3-carboxamide
CID 104762009
N-[(3-methoxyoxolan-3-yl)methyl]-3-piperidin-3-ylpropanamide
CID 104761551
N-[(4-methylsulfanyloxan-4-yl)methyl]-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119805571
2-amino-N-[(3-methoxyoxolan-3-yl)methyl]acetamide
CID 104761415
1-(azepan-2-yl)-N-[(3-methoxyoxolan-3-yl)methyl]propan-2-amine
CID 104759811
N-[(3-methoxyoxolan-3-yl)methyl]-5-pyrrolidin-2-yl-1,2,4-oxadiazole-3-carboxamide
CID 102742534
N-[(3-methoxyoxolan-3-yl)methyl]-2-methylpyrrolidine-3-carboxamide
CID 104761454
N-[(3-methoxyoxolan-3-yl)methyl]-2-(propan-2-ylamino)acetamide
CID 104761435
N-[[1-(2-methoxyethyl)cyclopentyl]methyl]-2-pyrrolidin-2-ylacetamide
CID 119812139
N-[(3-methoxyoxolan-3-yl)methyl]morpholine-3-carboxamide
CID 113450266
4-hydroxy-N-[(3-methoxyoxolan-3-yl)methyl]butanamide
CID 104766199
N-[(1-ethylcyclopentyl)methyl]-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119812251

Frequently Asked Questions

What is the IUPAC name of N-[(3-methoxyoxolan-3-yl)methyl]-2-pyrrolidin-2-ylacetamide?
The IUPAC name of N-[(3-methoxyoxolan-3-yl)methyl]-2-pyrrolidin-2-ylacetamide (CID 113450280) is N-[(3-methoxyoxolan-3-yl)methyl]-2-pyrrolidin-2-ylacetamide.
What is the SMILES notation for N-[(3-methoxyoxolan-3-yl)methyl]-2-pyrrolidin-2-ylacetamide?
The canonical SMILES for N-[(3-methoxyoxolan-3-yl)methyl]-2-pyrrolidin-2-ylacetamide is COC1(CNC(=O)CC2CCCN2)CCOC1.
What is the InChIKey of N-[(3-methoxyoxolan-3-yl)methyl]-2-pyrrolidin-2-ylacetamide?
The InChIKey is FZRBIZFBRWRYHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O3/c1-16-12(4-6-17-9-12)8-14-11(15)7-10-3-2-5-13-10/h10,13H,2-9H2,1H3,(H,14,15).
What are the key properties of N-[(3-methoxyoxolan-3-yl)methyl]-2-pyrrolidin-2-ylacetamide?
N-[(3-methoxyoxolan-3-yl)methyl]-2-pyrrolidin-2-ylacetamide has a molecular weight of 242.32 g/mol, XLogP of 0.05, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-methoxyoxolan-3-yl)methyl]-2-pyrrolidin-2-ylacetamide is sourced from PubChem (CID 113450280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).