3-cyclohexylpyrrolidine

C10H19N — CID 3159730

IUPAC3-cyclohexylpyrrolidine
SMILESC1CCC(C2CCNC2)CC1
InChIInChI=1S/C10H19N/c1-2-4-9(5-3-1)10-6-7-11-8-10/h9-11H,1-8H2
InChIKeyPJQCUMVGSKEOMN-UHFFFAOYSA-N
MW153.27 g/mol
LogP2.18
Rot. Bonds1

About 3-cyclohexylpyrrolidine

3-cyclohexylpyrrolidine (PubChem CID 3159730) has the molecular formula C10H19N and a molecular weight of 153.27 g/mol. Its IUPAC name is 3-cyclohexylpyrrolidine.

Molecular Properties

Compound Name3-cyclohexylpyrrolidine
PubChem CID3159730
Molecular FormulaC10H19N
Molecular Weight153.27 g/mol
Exact Mass153.15
IUPAC Name3-cyclohexylpyrrolidine
SMILESC1CCC(C2CCNC2)CC1
InChIInChI=1S/C10H19N/c1-2-4-9(5-3-1)10-6-7-11-8-10/h9-11H,1-8H2
InChIKeyPJQCUMVGSKEOMN-UHFFFAOYSA-N
XLogP2.18
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.27
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-cyclohexylpyrrolidine?
The IUPAC name of 3-cyclohexylpyrrolidine (CID 3159730) is 3-cyclohexylpyrrolidine.
What is the SMILES notation for 3-cyclohexylpyrrolidine?
The canonical SMILES for 3-cyclohexylpyrrolidine is C1CCC(C2CCNC2)CC1.
What is the InChIKey of 3-cyclohexylpyrrolidine?
The InChIKey is PJQCUMVGSKEOMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N/c1-2-4-9(5-3-1)10-6-7-11-8-10/h9-11H,1-8H2.
What are the key properties of 3-cyclohexylpyrrolidine?
3-cyclohexylpyrrolidine has a molecular weight of 153.27 g/mol, XLogP of 2.18, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclohexylpyrrolidine is sourced from PubChem (CID 3159730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).