N-[(1-ethylpyrrolidin-3-yl)methyl]-2-methoxyacetamide

C10H20N2O2 — CID 61242838

IUPACN-[(1-ethylpyrrolidin-3-yl)methyl]-2-methoxyacetamide
SMILESCCN1CCC(CNC(=O)COC)C1
InChIInChI=1S/C10H20N2O2/c1-3-12-5-4-9(7-12)6-11-10(13)8-14-2/h9H,3-8H2,1-2H3,(H,11,13)
InChIKeyCKHXKBMSGYUJDY-UHFFFAOYSA-N
MW200.28 g/mol
LogP0.09
Rot. Bonds5

About N-[(1-ethylpyrrolidin-3-yl)methyl]-2-methoxyacetamide

N-[(1-ethylpyrrolidin-3-yl)methyl]-2-methoxyacetamide (PubChem CID 61242838) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is N-[(1-ethylpyrrolidin-3-yl)methyl]-2-methoxyacetamide.

Molecular Properties

Compound NameN-[(1-ethylpyrrolidin-3-yl)methyl]-2-methoxyacetamide
PubChem CID61242838
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC NameN-[(1-ethylpyrrolidin-3-yl)methyl]-2-methoxyacetamide
SMILESCCN1CCC(CNC(=O)COC)C1
InChIInChI=1S/C10H20N2O2/c1-3-12-5-4-9(7-12)6-11-10(13)8-14-2/h9H,3-8H2,1-2H3,(H,11,13)
InChIKeyCKHXKBMSGYUJDY-UHFFFAOYSA-N
XLogP0.09
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 50.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(1-ethylpyrrolidin-3-yl)methyl]-2-methoxyacetamide?
The IUPAC name of N-[(1-ethylpyrrolidin-3-yl)methyl]-2-methoxyacetamide (CID 61242838) is N-[(1-ethylpyrrolidin-3-yl)methyl]-2-methoxyacetamide.
What is the SMILES notation for N-[(1-ethylpyrrolidin-3-yl)methyl]-2-methoxyacetamide?
The canonical SMILES for N-[(1-ethylpyrrolidin-3-yl)methyl]-2-methoxyacetamide is CCN1CCC(CNC(=O)COC)C1.
What is the InChIKey of N-[(1-ethylpyrrolidin-3-yl)methyl]-2-methoxyacetamide?
The InChIKey is CKHXKBMSGYUJDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2/c1-3-12-5-4-9(7-12)6-11-10(13)8-14-2/h9H,3-8H2,1-2H3,(H,11,13).
What are the key properties of N-[(1-ethylpyrrolidin-3-yl)methyl]-2-methoxyacetamide?
N-[(1-ethylpyrrolidin-3-yl)methyl]-2-methoxyacetamide has a molecular weight of 200.28 g/mol, XLogP of 0.09, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-ethylpyrrolidin-3-yl)methyl]-2-methoxyacetamide is sourced from PubChem (CID 61242838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).