N-[(3S)-7-azaspiro[3.5]nonan-3-yl]-2-methoxyacetamide

C11H20N2O2 — CID 99728128

IUPACN-[(3S)-7-azaspiro[3.5]nonan-3-yl]-2-methoxyacetamide
SMILESCOCC(=O)N[C@H]1CCC12CCNCC2
InChIInChI=1S/C11H20N2O2/c1-15-8-10(14)13-9-2-3-11(9)4-6-12-7-5-11/h9,12H,2-8H2,1H3,(H,13,14)/t9-/m0/s1
InChIKeyDQIWVUNRTBPZER-VIFPVBQESA-N
MW212.29 g/mol
LogP0.28
Rot. Bonds3

About N-[(3S)-7-azaspiro[3.5]nonan-3-yl]-2-methoxyacetamide

N-[(3S)-7-azaspiro[3.5]nonan-3-yl]-2-methoxyacetamide (PubChem CID 99728128) has the molecular formula C11H20N2O2 and a molecular weight of 212.29 g/mol. Its IUPAC name is N-[(3S)-7-azaspiro[3.5]nonan-3-yl]-2-methoxyacetamide.

Molecular Properties

Compound NameN-[(3S)-7-azaspiro[3.5]nonan-3-yl]-2-methoxyacetamide
PubChem CID99728128
Molecular FormulaC11H20N2O2
Molecular Weight212.29 g/mol
Exact Mass212.15
IUPAC NameN-[(3S)-7-azaspiro[3.5]nonan-3-yl]-2-methoxyacetamide
SMILESCOCC(=O)N[C@H]1CCC12CCNCC2
InChIInChI=1S/C11H20N2O2/c1-15-8-10(14)13-9-2-3-11(9)4-6-12-7-5-11/h9,12H,2-8H2,1H3,(H,13,14)/t9-/m0/s1
InChIKeyDQIWVUNRTBPZER-VIFPVBQESA-N
XLogP0.28
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.29
LogP ≤ 50.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(3S)-7-azaspiro[3.5]nonan-3-yl]-2-methoxyacetamide?
The IUPAC name of N-[(3S)-7-azaspiro[3.5]nonan-3-yl]-2-methoxyacetamide (CID 99728128) is N-[(3S)-7-azaspiro[3.5]nonan-3-yl]-2-methoxyacetamide.
What is the SMILES notation for N-[(3S)-7-azaspiro[3.5]nonan-3-yl]-2-methoxyacetamide?
The canonical SMILES for N-[(3S)-7-azaspiro[3.5]nonan-3-yl]-2-methoxyacetamide is COCC(=O)N[C@H]1CCC12CCNCC2.
What is the InChIKey of N-[(3S)-7-azaspiro[3.5]nonan-3-yl]-2-methoxyacetamide?
The InChIKey is DQIWVUNRTBPZER-VIFPVBQESA-N. The full InChI is InChI=1S/C11H20N2O2/c1-15-8-10(14)13-9-2-3-11(9)4-6-12-7-5-11/h9,12H,2-8H2,1H3,(H,13,14)/t9-/m0/s1.
What are the key properties of N-[(3S)-7-azaspiro[3.5]nonan-3-yl]-2-methoxyacetamide?
N-[(3S)-7-azaspiro[3.5]nonan-3-yl]-2-methoxyacetamide has a molecular weight of 212.29 g/mol, XLogP of 0.28, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3S)-7-azaspiro[3.5]nonan-3-yl]-2-methoxyacetamide is sourced from PubChem (CID 99728128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).