N-(1-methoxypropan-2-yl)-2-pyrrolidin-1-ylacetamide

C10H20N2O2 — CID 47010383

IUPACN-(1-methoxypropan-2-yl)-2-pyrrolidin-1-ylacetamide
SMILESCC(COC)NC(=O)CN1CCCC1
InChIInChI=1S/C10H20N2O2/c1-9(8-14-2)11-10(13)7-12-5-3-4-6-12/h9H,3-8H2,1-2H3,(H,11,13)
InChIKeyKMBFBOCVAJXMPZ-UHFFFAOYSA-N
MW200.28 g/mol
LogP0.40
Rot. Bonds5

About N-(1-methoxypropan-2-yl)-2-pyrrolidin-1-ylacetamide

N-(1-methoxypropan-2-yl)-2-pyrrolidin-1-ylacetamide (PubChem CID 47010383) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is N-(1-methoxypropan-2-yl)-2-pyrrolidin-1-ylacetamide.

Molecular Properties

Compound NameN-(1-methoxypropan-2-yl)-2-pyrrolidin-1-ylacetamide
PubChem CID47010383
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC NameN-(1-methoxypropan-2-yl)-2-pyrrolidin-1-ylacetamide
SMILESCC(COC)NC(=O)CN1CCCC1
InChIInChI=1S/C10H20N2O2/c1-9(8-14-2)11-10(13)7-12-5-3-4-6-12/h9H,3-8H2,1-2H3,(H,11,13)
InChIKeyKMBFBOCVAJXMPZ-UHFFFAOYSA-N
XLogP0.40
TPSA41.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity179

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 50.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1-methoxypropan-2-yl)-2-pyrrolidin-1-ylacetamide?
The IUPAC name of N-(1-methoxypropan-2-yl)-2-pyrrolidin-1-ylacetamide (CID 47010383) is N-(1-methoxypropan-2-yl)-2-pyrrolidin-1-ylacetamide.
What is the SMILES notation for N-(1-methoxypropan-2-yl)-2-pyrrolidin-1-ylacetamide?
The canonical SMILES for N-(1-methoxypropan-2-yl)-2-pyrrolidin-1-ylacetamide is CC(COC)NC(=O)CN1CCCC1.
What is the InChIKey of N-(1-methoxypropan-2-yl)-2-pyrrolidin-1-ylacetamide?
The InChIKey is KMBFBOCVAJXMPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2/c1-9(8-14-2)11-10(13)7-12-5-3-4-6-12/h9H,3-8H2,1-2H3,(H,11,13).
What are the key properties of N-(1-methoxypropan-2-yl)-2-pyrrolidin-1-ylacetamide?
N-(1-methoxypropan-2-yl)-2-pyrrolidin-1-ylacetamide has a molecular weight of 200.28 g/mol, XLogP of 0.40, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methoxypropan-2-yl)-2-pyrrolidin-1-ylacetamide is sourced from PubChem (CID 47010383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).