2-[cyclopropyl(propyl)amino]cyclopentan-1-one

C11H19NO — CID 43795493

IUPAC2-[cyclopropyl(propyl)amino]cyclopentan-1-one
SMILESCCCN(C1CC1)C1CCCC1=O
InChIInChI=1S/C11H19NO/c1-2-8-12(9-6-7-9)10-4-3-5-11(10)13/h9-10H,2-8H2,1H3
InChIKeyFKBMCJNZTVTHRU-UHFFFAOYSA-N
MW181.28 g/mol
LogP1.98
Rot. Bonds4

About 2-[cyclopropyl(propyl)amino]cyclopentan-1-one

2-[cyclopropyl(propyl)amino]cyclopentan-1-one (PubChem CID 43795493) has the molecular formula C11H19NO and a molecular weight of 181.28 g/mol. Its IUPAC name is 2-[cyclopropyl(propyl)amino]cyclopentan-1-one.

Molecular Properties

Compound Name2-[cyclopropyl(propyl)amino]cyclopentan-1-one
PubChem CID43795493
Molecular FormulaC11H19NO
Molecular Weight181.28 g/mol
Exact Mass181.15
IUPAC Name2-[cyclopropyl(propyl)amino]cyclopentan-1-one
SMILESCCCN(C1CC1)C1CCCC1=O
InChIInChI=1S/C11H19NO/c1-2-8-12(9-6-7-9)10-4-3-5-11(10)13/h9-10H,2-8H2,1H3
InChIKeyFKBMCJNZTVTHRU-UHFFFAOYSA-N
XLogP1.98
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.28
LogP ≤ 51.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[cyclopropyl(propyl)amino]cyclopentan-1-one?
The IUPAC name of 2-[cyclopropyl(propyl)amino]cyclopentan-1-one (CID 43795493) is 2-[cyclopropyl(propyl)amino]cyclopentan-1-one.
What is the SMILES notation for 2-[cyclopropyl(propyl)amino]cyclopentan-1-one?
The canonical SMILES for 2-[cyclopropyl(propyl)amino]cyclopentan-1-one is CCCN(C1CC1)C1CCCC1=O.
What is the InChIKey of 2-[cyclopropyl(propyl)amino]cyclopentan-1-one?
The InChIKey is FKBMCJNZTVTHRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO/c1-2-8-12(9-6-7-9)10-4-3-5-11(10)13/h9-10H,2-8H2,1H3.
What are the key properties of 2-[cyclopropyl(propyl)amino]cyclopentan-1-one?
2-[cyclopropyl(propyl)amino]cyclopentan-1-one has a molecular weight of 181.28 g/mol, XLogP of 1.98, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopropyl(propyl)amino]cyclopentan-1-one is sourced from PubChem (CID 43795493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).