4-cyclohexyl-1,2,2,4-tetramethylpyrrolidine

C14H27N — CID 162435864

IUPAC4-cyclohexyl-1,2,2,4-tetramethylpyrrolidine
SMILESCN1CC(C)(C2CCCCC2)CC1(C)C
InChIInChI=1S/C14H27N/c1-13(2)10-14(3,11-15(13)4)12-8-6-5-7-9-12/h12H,5-11H2,1-4H3
InChIKeyURRRYEPHTUGPOE-UHFFFAOYSA-N
MW209.38 g/mol
LogP3.69
Rot. Bonds1

About 4-cyclohexyl-1,2,2,4-tetramethylpyrrolidine

4-cyclohexyl-1,2,2,4-tetramethylpyrrolidine (PubChem CID 162435864) has the molecular formula C14H27N and a molecular weight of 209.38 g/mol. Its IUPAC name is 4-cyclohexyl-1,2,2,4-tetramethylpyrrolidine.

Molecular Properties

Compound Name4-cyclohexyl-1,2,2,4-tetramethylpyrrolidine
PubChem CID162435864
Molecular FormulaC14H27N
Molecular Weight209.38 g/mol
Exact Mass209.21
IUPAC Name4-cyclohexyl-1,2,2,4-tetramethylpyrrolidine
SMILESCN1CC(C)(C2CCCCC2)CC1(C)C
InChIInChI=1S/C14H27N/c1-13(2)10-14(3,11-15(13)4)12-8-6-5-7-9-12/h12H,5-11H2,1-4H3
InChIKeyURRRYEPHTUGPOE-UHFFFAOYSA-N
XLogP3.69
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.38
LogP ≤ 53.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-cyclohexyl-1,2,2,4-tetramethylpyrrolidine?
The IUPAC name of 4-cyclohexyl-1,2,2,4-tetramethylpyrrolidine (CID 162435864) is 4-cyclohexyl-1,2,2,4-tetramethylpyrrolidine.
What is the SMILES notation for 4-cyclohexyl-1,2,2,4-tetramethylpyrrolidine?
The canonical SMILES for 4-cyclohexyl-1,2,2,4-tetramethylpyrrolidine is CN1CC(C)(C2CCCCC2)CC1(C)C.
What is the InChIKey of 4-cyclohexyl-1,2,2,4-tetramethylpyrrolidine?
The InChIKey is URRRYEPHTUGPOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N/c1-13(2)10-14(3,11-15(13)4)12-8-6-5-7-9-12/h12H,5-11H2,1-4H3.
What are the key properties of 4-cyclohexyl-1,2,2,4-tetramethylpyrrolidine?
4-cyclohexyl-1,2,2,4-tetramethylpyrrolidine has a molecular weight of 209.38 g/mol, XLogP of 3.69, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclohexyl-1,2,2,4-tetramethylpyrrolidine is sourced from PubChem (CID 162435864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).