3-(methylamino)cyclopentan-1-one

C6H11NO — CID 91562222

IUPAC3-(methylamino)cyclopentan-1-one
SMILESCNC1CCC(=O)C1
InChIInChI=1S/C6H11NO/c1-7-5-2-3-6(8)4-5/h5,7H,2-4H2,1H3
InChIKeyWGPGSNJEDOVIDI-UHFFFAOYSA-N
MW113.16 g/mol
LogP0.33
Rot. Bonds1

About 3-(methylamino)cyclopentan-1-one

3-(methylamino)cyclopentan-1-one (PubChem CID 91562222) has the molecular formula C6H11NO and a molecular weight of 113.16 g/mol. Its IUPAC name is 3-(methylamino)cyclopentan-1-one.

Molecular Properties

Compound Name3-(methylamino)cyclopentan-1-one
PubChem CID91562222
Molecular FormulaC6H11NO
Molecular Weight113.16 g/mol
Exact Mass113.08
IUPAC Name3-(methylamino)cyclopentan-1-one
SMILESCNC1CCC(=O)C1
InChIInChI=1S/C6H11NO/c1-7-5-2-3-6(8)4-5/h5,7H,2-4H2,1H3
InChIKeyWGPGSNJEDOVIDI-UHFFFAOYSA-N
XLogP0.33
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500113.16
LogP ≤ 50.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(methylamino)cyclopentan-1-one?
The IUPAC name of 3-(methylamino)cyclopentan-1-one (CID 91562222) is 3-(methylamino)cyclopentan-1-one.
What is the SMILES notation for 3-(methylamino)cyclopentan-1-one?
The canonical SMILES for 3-(methylamino)cyclopentan-1-one is CNC1CCC(=O)C1.
What is the InChIKey of 3-(methylamino)cyclopentan-1-one?
The InChIKey is WGPGSNJEDOVIDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO/c1-7-5-2-3-6(8)4-5/h5,7H,2-4H2,1H3.
What are the key properties of 3-(methylamino)cyclopentan-1-one?
3-(methylamino)cyclopentan-1-one has a molecular weight of 113.16 g/mol, XLogP of 0.33, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(methylamino)cyclopentan-1-one is sourced from PubChem (CID 91562222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).