N-(3-methylbutyl)-2-pyrrolidin-3-yloxyacetamide

C11H22N2O2 — CID 62329455

IUPACN-(3-methylbutyl)-2-pyrrolidin-3-yloxyacetamide
SMILESCC(C)CCNC(=O)COC1CCNC1
InChIInChI=1S/C11H22N2O2/c1-9(2)3-6-13-11(14)8-15-10-4-5-12-7-10/h9-10,12H,3-8H2,1-2H3,(H,13,14)
InChIKeyGURGJNBODIVZLC-UHFFFAOYSA-N
MW214.31 g/mol
LogP0.53
Rot. Bonds6

About N-(3-methylbutyl)-2-pyrrolidin-3-yloxyacetamide

N-(3-methylbutyl)-2-pyrrolidin-3-yloxyacetamide (PubChem CID 62329455) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is N-(3-methylbutyl)-2-pyrrolidin-3-yloxyacetamide.

Molecular Properties

Compound NameN-(3-methylbutyl)-2-pyrrolidin-3-yloxyacetamide
PubChem CID62329455
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC NameN-(3-methylbutyl)-2-pyrrolidin-3-yloxyacetamide
SMILESCC(C)CCNC(=O)COC1CCNC1
InChIInChI=1S/C11H22N2O2/c1-9(2)3-6-13-11(14)8-15-10-4-5-12-7-10/h9-10,12H,3-8H2,1-2H3,(H,13,14)
InChIKeyGURGJNBODIVZLC-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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Frequently Asked Questions

What is the IUPAC name of N-(3-methylbutyl)-2-pyrrolidin-3-yloxyacetamide?
The IUPAC name of N-(3-methylbutyl)-2-pyrrolidin-3-yloxyacetamide (CID 62329455) is N-(3-methylbutyl)-2-pyrrolidin-3-yloxyacetamide.
What is the SMILES notation for N-(3-methylbutyl)-2-pyrrolidin-3-yloxyacetamide?
The canonical SMILES for N-(3-methylbutyl)-2-pyrrolidin-3-yloxyacetamide is CC(C)CCNC(=O)COC1CCNC1.
What is the InChIKey of N-(3-methylbutyl)-2-pyrrolidin-3-yloxyacetamide?
The InChIKey is GURGJNBODIVZLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-9(2)3-6-13-11(14)8-15-10-4-5-12-7-10/h9-10,12H,3-8H2,1-2H3,(H,13,14).
What are the key properties of N-(3-methylbutyl)-2-pyrrolidin-3-yloxyacetamide?
N-(3-methylbutyl)-2-pyrrolidin-3-yloxyacetamide 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 N-(3-methylbutyl)-2-pyrrolidin-3-yloxyacetamide is sourced from PubChem (CID 62329455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).