2-propan-2-yloxy-N-(2-pyrrolidin-3-ylethyl)acetamide

C11H22N2O2 — CID 112701317

IUPAC2-propan-2-yloxy-N-(2-pyrrolidin-3-ylethyl)acetamide
SMILESCC(C)OCC(=O)NCCC1CCNC1
InChIInChI=1S/C11H22N2O2/c1-9(2)15-8-11(14)13-6-4-10-3-5-12-7-10/h9-10,12H,3-8H2,1-2H3,(H,13,14)
InChIKeyLODVFTJSTBEMOR-UHFFFAOYSA-N
MW214.31 g/mol
LogP0.53
Rot. Bonds6

About 2-propan-2-yloxy-N-(2-pyrrolidin-3-ylethyl)acetamide

2-propan-2-yloxy-N-(2-pyrrolidin-3-ylethyl)acetamide (PubChem CID 112701317) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is 2-propan-2-yloxy-N-(2-pyrrolidin-3-ylethyl)acetamide.

Molecular Properties

Compound Name2-propan-2-yloxy-N-(2-pyrrolidin-3-ylethyl)acetamide
PubChem CID112701317
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC Name2-propan-2-yloxy-N-(2-pyrrolidin-3-ylethyl)acetamide
SMILESCC(C)OCC(=O)NCCC1CCNC1
InChIInChI=1S/C11H22N2O2/c1-9(2)15-8-11(14)13-6-4-10-3-5-12-7-10/h9-10,12H,3-8H2,1-2H3,(H,13,14)
InChIKeyLODVFTJSTBEMOR-UHFFFAOYSA-N
XLogP0.53
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 50.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-propan-2-ylphenoxy)-N-(2-pyrrolidin-3-ylethyl)acetamide;hydrochloride
CID 119536634
3-methoxy-N-(2-pyrrolidin-3-ylethyl)propanamide
CID 63630087
3-piperidin-4-yl-N-(2-piperidin-3-ylethyl)butanamide
CID 122080536
2-ethyl-N-(2-pyrrolidin-3-ylethyl)butanamide
CID 63624155
2,3,3-trimethyl-N-(2-pyrrolidin-3-ylethyl)butanamide;hydrochloride
CID 119534841
2-(diethylsulfamoyl)-N-(2-pyrrolidin-3-ylethyl)acetamide
CID 119538205
2-(4-chlorophenoxy)-N-(2-pyrrolidin-3-ylethyl)acetamide
CID 63624340
N-[4-oxo-4-(2-pyrrolidin-3-ylethylamino)butan-2-yl]cyclohexanecarboxamide;hydrochloride
CID 119534348
2-butoxy-N-(2-piperidin-3-ylethyl)acetamide
CID 119556293
2-(4-chloro-3-methylphenoxy)-N-(2-pyrrolidin-3-ylethyl)acetamide
CID 119535909
N-(4-methylpiperidin-3-yl)-2-propan-2-yloxyacetamide
CID 112602525
4-methyl-3-phenyl-N-(2-pyrrolidin-3-ylethyl)pentanamide;hydrochloride
CID 119533754

Frequently Asked Questions

What is the IUPAC name of 2-propan-2-yloxy-N-(2-pyrrolidin-3-ylethyl)acetamide?
The IUPAC name of 2-propan-2-yloxy-N-(2-pyrrolidin-3-ylethyl)acetamide (CID 112701317) is 2-propan-2-yloxy-N-(2-pyrrolidin-3-ylethyl)acetamide.
What is the SMILES notation for 2-propan-2-yloxy-N-(2-pyrrolidin-3-ylethyl)acetamide?
The canonical SMILES for 2-propan-2-yloxy-N-(2-pyrrolidin-3-ylethyl)acetamide is CC(C)OCC(=O)NCCC1CCNC1.
What is the InChIKey of 2-propan-2-yloxy-N-(2-pyrrolidin-3-ylethyl)acetamide?
The InChIKey is LODVFTJSTBEMOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-9(2)15-8-11(14)13-6-4-10-3-5-12-7-10/h9-10,12H,3-8H2,1-2H3,(H,13,14).
What are the key properties of 2-propan-2-yloxy-N-(2-pyrrolidin-3-ylethyl)acetamide?
2-propan-2-yloxy-N-(2-pyrrolidin-3-ylethyl)acetamide has a molecular weight of 214.31 g/mol, XLogP of 0.53, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propan-2-yloxy-N-(2-pyrrolidin-3-ylethyl)acetamide is sourced from PubChem (CID 112701317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).