cyclohexyl(pyrrolidin-1-yl)methanone

C11H19NO — CID 5087171

IUPACcyclohexyl(pyrrolidin-1-yl)methanone
SMILESO=C(C1CCCCC1)N1CCCC1
InChIInChI=1S/C11H19NO/c13-11(12-8-4-5-9-12)10-6-2-1-3-7-10/h10H,1-9H2
InChIKeyKDKGYXLLJLLXLN-UHFFFAOYSA-N
MW181.28 g/mol
LogP2.19
Rot. Bonds1

About cyclohexyl(pyrrolidin-1-yl)methanone

cyclohexyl(pyrrolidin-1-yl)methanone (PubChem CID 5087171) has the molecular formula C11H19NO and a molecular weight of 181.28 g/mol. Its IUPAC name is cyclohexyl(pyrrolidin-1-yl)methanone.

Molecular Properties

Compound Namecyclohexyl(pyrrolidin-1-yl)methanone
PubChem CID5087171
Molecular FormulaC11H19NO
Molecular Weight181.28 g/mol
Exact Mass181.15
IUPAC Namecyclohexyl(pyrrolidin-1-yl)methanone
SMILESO=C(C1CCCCC1)N1CCCC1
InChIInChI=1S/C11H19NO/c13-11(12-8-4-5-9-12)10-6-2-1-3-7-10/h10H,1-9H2
InChIKeyKDKGYXLLJLLXLN-UHFFFAOYSA-N
XLogP2.19
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.28
LogP ≤ 52.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of cyclohexyl(pyrrolidin-1-yl)methanone?
The IUPAC name of cyclohexyl(pyrrolidin-1-yl)methanone (CID 5087171) is cyclohexyl(pyrrolidin-1-yl)methanone.
What is the SMILES notation for cyclohexyl(pyrrolidin-1-yl)methanone?
The canonical SMILES for cyclohexyl(pyrrolidin-1-yl)methanone is O=C(C1CCCCC1)N1CCCC1.
What is the InChIKey of cyclohexyl(pyrrolidin-1-yl)methanone?
The InChIKey is KDKGYXLLJLLXLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO/c13-11(12-8-4-5-9-12)10-6-2-1-3-7-10/h10H,1-9H2.
What are the key properties of cyclohexyl(pyrrolidin-1-yl)methanone?
cyclohexyl(pyrrolidin-1-yl)methanone has a molecular weight of 181.28 g/mol, XLogP of 2.19, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexyl(pyrrolidin-1-yl)methanone is sourced from PubChem (CID 5087171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).