2-[(2-methylpropan-2-yl)oxy]-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]acetamide

C14H28N2O2 — CID 112605266

IUPAC2-[(2-methylpropan-2-yl)oxy]-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]acetamide
SMILESCC(C)N1CCC(CNC(=O)COC(C)(C)C)C1
InChIInChI=1S/C14H28N2O2/c1-11(2)16-7-6-12(9-16)8-15-13(17)10-18-14(3,4)5/h11-12H,6-10H2,1-5H3,(H,15,17)
InChIKeyULNYKGYTWOYDMN-UHFFFAOYSA-N
MW256.39 g/mol
LogP1.65
Rot. Bonds5

About 2-[(2-methylpropan-2-yl)oxy]-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]acetamide

2-[(2-methylpropan-2-yl)oxy]-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]acetamide (PubChem CID 112605266) has the molecular formula C14H28N2O2 and a molecular weight of 256.39 g/mol. Its IUPAC name is 2-[(2-methylpropan-2-yl)oxy]-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]acetamide.

Molecular Properties

Compound Name2-[(2-methylpropan-2-yl)oxy]-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]acetamide
PubChem CID112605266
Molecular FormulaC14H28N2O2
Molecular Weight256.39 g/mol
Exact Mass256.22
IUPAC Name2-[(2-methylpropan-2-yl)oxy]-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]acetamide
SMILESCC(C)N1CCC(CNC(=O)COC(C)(C)C)C1
InChIInChI=1S/C14H28N2O2/c1-11(2)16-7-6-12(9-16)8-15-13(17)10-18-14(3,4)5/h11-12H,6-10H2,1-5H3,(H,15,17)
InChIKeyULNYKGYTWOYDMN-UHFFFAOYSA-N
XLogP1.65
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-ethoxy-N-((1-methylpyrrolidin-3-yl)methyl)acetamide
CID 63365315
9-Methyl-6-oxa-2,9-diazaspiro[4.5]decan-8-one hydrochloride
CID 75531144
N-[[(3R)-1-cyclohexylpyrrolidin-3-yl]methyl]-2-ethoxy-2-methylpropanamide
CID 125447054
2-propan-2-yloxy-N-[[1-(2,2,2-trifluoroethyl)pyrrolidin-3-yl]methyl]acetamide
CID 48205220
2-ethoxy-N-[[1-(2,2,2-trifluoroethyl)pyrrolidin-3-yl]methyl]acetamide
CID 61244493
2-methoxy-N-[[1-(2,2,2-trifluoroethyl)pyrrolidin-3-yl]methyl]acetamide
CID 61244679
9-Methyl-6-oxa-2,9-diazaspiro[4.5]decan-8-one
CID 74890145
2-(2-aminoethoxy)-N-[[1-(2,2,2-trifluoroethyl)pyrrolidin-3-yl]methyl]acetamide
CID 79473061
N-(2-methyl-3-pyrrolidin-1-ylpropyl)-2-(2,2,2-trifluoroethoxy)acetamide
CID 87025952
2-(3-methylazetidin-3-yl)oxy-N-[[1-(2,2,2-trifluoroethyl)pyrrolidin-3-yl]methyl]acetamide
CID 102611867
1-[3-(Methylaminomethyl)pyrrolidin-1-yl]-2-(2,2,2-trifluoroethoxy)ethanone
CID 103806613
2-[(2-methylpropan-2-yl)oxy]-N-[[1-(2,2,2-trifluoroethyl)pyrrolidin-3-yl]methyl]acetamide
CID 115950334

Frequently Asked Questions

What is the IUPAC name of 2-[(2-methylpropan-2-yl)oxy]-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]acetamide?
The IUPAC name of 2-[(2-methylpropan-2-yl)oxy]-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]acetamide (CID 112605266) is 2-[(2-methylpropan-2-yl)oxy]-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]acetamide.
What is the SMILES notation for 2-[(2-methylpropan-2-yl)oxy]-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]acetamide?
The canonical SMILES for 2-[(2-methylpropan-2-yl)oxy]-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]acetamide is CC(C)N1CCC(CNC(=O)COC(C)(C)C)C1.
What is the InChIKey of 2-[(2-methylpropan-2-yl)oxy]-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]acetamide?
The InChIKey is ULNYKGYTWOYDMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O2/c1-11(2)16-7-6-12(9-16)8-15-13(17)10-18-14(3,4)5/h11-12H,6-10H2,1-5H3,(H,15,17).
What are the key properties of 2-[(2-methylpropan-2-yl)oxy]-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]acetamide?
2-[(2-methylpropan-2-yl)oxy]-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]acetamide has a molecular weight of 256.39 g/mol, XLogP of 1.65, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-methylpropan-2-yl)oxy]-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]acetamide is sourced from PubChem (CID 112605266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).