2-[2-[methyl(propyl)amino]ethyl]cyclobutan-1-one

C10H19NO — CID 165449059

IUPAC2-[2-[methyl(propyl)amino]ethyl]cyclobutan-1-one
SMILESCCCN(C)CCC1CCC1=O
InChIInChI=1S/C10H19NO/c1-3-7-11(2)8-6-9-4-5-10(9)12/h9H,3-8H2,1-2H3
InChIKeyFVKFSZBLAILLGE-UHFFFAOYSA-N
MW169.27 g/mol
LogP1.70
Rot. Bonds5

About 2-[2-[methyl(propyl)amino]ethyl]cyclobutan-1-one

2-[2-[methyl(propyl)amino]ethyl]cyclobutan-1-one (PubChem CID 165449059) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is 2-[2-[methyl(propyl)amino]ethyl]cyclobutan-1-one.

Molecular Properties

Compound Name2-[2-[methyl(propyl)amino]ethyl]cyclobutan-1-one
PubChem CID165449059
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name2-[2-[methyl(propyl)amino]ethyl]cyclobutan-1-one
SMILESCCCN(C)CCC1CCC1=O
InChIInChI=1S/C10H19NO/c1-3-7-11(2)8-6-9-4-5-10(9)12/h9H,3-8H2,1-2H3
InChIKeyFVKFSZBLAILLGE-UHFFFAOYSA-N
XLogP1.70
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 51.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[2-[methyl(propyl)amino]ethyl]cyclobutan-1-one?
The IUPAC name of 2-[2-[methyl(propyl)amino]ethyl]cyclobutan-1-one (CID 165449059) is 2-[2-[methyl(propyl)amino]ethyl]cyclobutan-1-one.
What is the SMILES notation for 2-[2-[methyl(propyl)amino]ethyl]cyclobutan-1-one?
The canonical SMILES for 2-[2-[methyl(propyl)amino]ethyl]cyclobutan-1-one is CCCN(C)CCC1CCC1=O.
What is the InChIKey of 2-[2-[methyl(propyl)amino]ethyl]cyclobutan-1-one?
The InChIKey is FVKFSZBLAILLGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO/c1-3-7-11(2)8-6-9-4-5-10(9)12/h9H,3-8H2,1-2H3.
What are the key properties of 2-[2-[methyl(propyl)amino]ethyl]cyclobutan-1-one?
2-[2-[methyl(propyl)amino]ethyl]cyclobutan-1-one has a molecular weight of 169.27 g/mol, XLogP of 1.70, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[methyl(propyl)amino]ethyl]cyclobutan-1-one is sourced from PubChem (CID 165449059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).