2-methoxy-N-[2-[(3R)-3-methylpiperidin-1-yl]ethyl]acetamide

C11H22N2O2 — CID 94116180

IUPAC2-methoxy-N-[2-[(3R)-3-methylpiperidin-1-yl]ethyl]acetamide
SMILESCOCC(=O)NCCN1CCC[C@@H](C)C1
InChIInChI=1S/C11H22N2O2/c1-10-4-3-6-13(8-10)7-5-12-11(14)9-15-2/h10H,3-9H2,1-2H3,(H,12,14)/t10-/m1/s1
InChIKeyIKSRQXULRNAAJQ-SNVBAGLBSA-N
MW214.31 g/mol
LogP0.48
Rot. Bonds5

About 2-methoxy-N-[2-[(3R)-3-methylpiperidin-1-yl]ethyl]acetamide

2-methoxy-N-[2-[(3R)-3-methylpiperidin-1-yl]ethyl]acetamide (PubChem CID 94116180) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is 2-methoxy-N-[2-[(3R)-3-methylpiperidin-1-yl]ethyl]acetamide.

Molecular Properties

Compound Name2-methoxy-N-[2-[(3R)-3-methylpiperidin-1-yl]ethyl]acetamide
PubChem CID94116180
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC Name2-methoxy-N-[2-[(3R)-3-methylpiperidin-1-yl]ethyl]acetamide
SMILESCOCC(=O)NCCN1CCC[C@@H](C)C1
InChIInChI=1S/C11H22N2O2/c1-10-4-3-6-13(8-10)7-5-12-11(14)9-15-2/h10H,3-9H2,1-2H3,(H,12,14)/t10-/m1/s1
InChIKeyIKSRQXULRNAAJQ-SNVBAGLBSA-N
XLogP0.48
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 50.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[2-[(3R)-3-methylpiperidin-1-yl]ethyl]acetamide?
The IUPAC name of 2-methoxy-N-[2-[(3R)-3-methylpiperidin-1-yl]ethyl]acetamide (CID 94116180) is 2-methoxy-N-[2-[(3R)-3-methylpiperidin-1-yl]ethyl]acetamide.
What is the SMILES notation for 2-methoxy-N-[2-[(3R)-3-methylpiperidin-1-yl]ethyl]acetamide?
The canonical SMILES for 2-methoxy-N-[2-[(3R)-3-methylpiperidin-1-yl]ethyl]acetamide is COCC(=O)NCCN1CCC[C@@H](C)C1.
What is the InChIKey of 2-methoxy-N-[2-[(3R)-3-methylpiperidin-1-yl]ethyl]acetamide?
The InChIKey is IKSRQXULRNAAJQ-SNVBAGLBSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-10-4-3-6-13(8-10)7-5-12-11(14)9-15-2/h10H,3-9H2,1-2H3,(H,12,14)/t10-/m1/s1.
What are the key properties of 2-methoxy-N-[2-[(3R)-3-methylpiperidin-1-yl]ethyl]acetamide?
2-methoxy-N-[2-[(3R)-3-methylpiperidin-1-yl]ethyl]acetamide has a molecular weight of 214.31 g/mol, XLogP of 0.48, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[2-[(3R)-3-methylpiperidin-1-yl]ethyl]acetamide is sourced from PubChem (CID 94116180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).