2-cyclohexyl-2,5-dimethylpyrrolidine-1-carboxamide

C13H24N2O — CID 69349390

IUPAC2-cyclohexyl-2,5-dimethylpyrrolidine-1-carboxamide
SMILESCC1CCC(C)(C2CCCCC2)N1C(N)=O
InChIInChI=1S/C13H24N2O/c1-10-8-9-13(2,15(10)12(14)16)11-6-4-3-5-7-11/h10-11H,3-9H2,1-2H3,(H2,14,16)
InChIKeyUTNCLIBMAHZNLO-UHFFFAOYSA-N
MW224.35 g/mol
LogP2.89
Rot. Bonds1

About 2-cyclohexyl-2,5-dimethylpyrrolidine-1-carboxamide

2-cyclohexyl-2,5-dimethylpyrrolidine-1-carboxamide (PubChem CID 69349390) has the molecular formula C13H24N2O and a molecular weight of 224.35 g/mol. Its IUPAC name is 2-cyclohexyl-2,5-dimethylpyrrolidine-1-carboxamide.

Molecular Properties

Compound Name2-cyclohexyl-2,5-dimethylpyrrolidine-1-carboxamide
PubChem CID69349390
Molecular FormulaC13H24N2O
Molecular Weight224.35 g/mol
Exact Mass224.19
IUPAC Name2-cyclohexyl-2,5-dimethylpyrrolidine-1-carboxamide
SMILESCC1CCC(C)(C2CCCCC2)N1C(N)=O
InChIInChI=1S/C13H24N2O/c1-10-8-9-13(2,15(10)12(14)16)11-6-4-3-5-7-11/h10-11H,3-9H2,1-2H3,(H2,14,16)
InChIKeyUTNCLIBMAHZNLO-UHFFFAOYSA-N
XLogP2.89
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.35
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-2,5-dimethylpyrrolidine-1-carboxamide?
The IUPAC name of 2-cyclohexyl-2,5-dimethylpyrrolidine-1-carboxamide (CID 69349390) is 2-cyclohexyl-2,5-dimethylpyrrolidine-1-carboxamide.
What is the SMILES notation for 2-cyclohexyl-2,5-dimethylpyrrolidine-1-carboxamide?
The canonical SMILES for 2-cyclohexyl-2,5-dimethylpyrrolidine-1-carboxamide is CC1CCC(C)(C2CCCCC2)N1C(N)=O.
What is the InChIKey of 2-cyclohexyl-2,5-dimethylpyrrolidine-1-carboxamide?
The InChIKey is UTNCLIBMAHZNLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O/c1-10-8-9-13(2,15(10)12(14)16)11-6-4-3-5-7-11/h10-11H,3-9H2,1-2H3,(H2,14,16).
What are the key properties of 2-cyclohexyl-2,5-dimethylpyrrolidine-1-carboxamide?
2-cyclohexyl-2,5-dimethylpyrrolidine-1-carboxamide has a molecular weight of 224.35 g/mol, XLogP of 2.89, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-2,5-dimethylpyrrolidine-1-carboxamide is sourced from PubChem (CID 69349390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).