1-(1-aminocyclopentyl)-2-methoxyethanone

C8H15NO2 — CID 116558746

IUPAC1-(1-aminocyclopentyl)-2-methoxyethanone
SMILESCOCC(=O)C1(N)CCCC1
InChIInChI=1S/C8H15NO2/c1-11-6-7(10)8(9)4-2-3-5-8/h2-6,9H2,1H3
InChIKeyMZBGTTROVSNNPP-UHFFFAOYSA-N
MW157.21 g/mol
LogP0.47
Rot. Bonds3

About 1-(1-aminocyclopentyl)-2-methoxyethanone

1-(1-aminocyclopentyl)-2-methoxyethanone (PubChem CID 116558746) has the molecular formula C8H15NO2 and a molecular weight of 157.21 g/mol. Its IUPAC name is 1-(1-aminocyclopentyl)-2-methoxyethanone.

Molecular Properties

Compound Name1-(1-aminocyclopentyl)-2-methoxyethanone
PubChem CID116558746
Molecular FormulaC8H15NO2
Molecular Weight157.21 g/mol
Exact Mass157.11
IUPAC Name1-(1-aminocyclopentyl)-2-methoxyethanone
SMILESCOCC(=O)C1(N)CCCC1
InChIInChI=1S/C8H15NO2/c1-11-6-7(10)8(9)4-2-3-5-8/h2-6,9H2,1H3
InChIKeyMZBGTTROVSNNPP-UHFFFAOYSA-N
XLogP0.47
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.21
LogP ≤ 50.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(1-aminocyclopentyl)-2-methoxyethanone?
The IUPAC name of 1-(1-aminocyclopentyl)-2-methoxyethanone (CID 116558746) is 1-(1-aminocyclopentyl)-2-methoxyethanone.
What is the SMILES notation for 1-(1-aminocyclopentyl)-2-methoxyethanone?
The canonical SMILES for 1-(1-aminocyclopentyl)-2-methoxyethanone is COCC(=O)C1(N)CCCC1.
What is the InChIKey of 1-(1-aminocyclopentyl)-2-methoxyethanone?
The InChIKey is MZBGTTROVSNNPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO2/c1-11-6-7(10)8(9)4-2-3-5-8/h2-6,9H2,1H3.
What are the key properties of 1-(1-aminocyclopentyl)-2-methoxyethanone?
1-(1-aminocyclopentyl)-2-methoxyethanone has a molecular weight of 157.21 g/mol, XLogP of 0.47, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-aminocyclopentyl)-2-methoxyethanone is sourced from PubChem (CID 116558746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).