2-cyclopentyl-2-propylpyrrolidine

C12H23N — CID 66466252

IUPAC2-cyclopentyl-2-propylpyrrolidine
SMILESCCCC1(C2CCCC2)CCCN1
InChIInChI=1S/C12H23N/c1-2-8-12(9-5-10-13-12)11-6-3-4-7-11/h11,13H,2-10H2,1H3
InChIKeyJJZLDALNASHJLV-UHFFFAOYSA-N
MW181.32 g/mol
LogP3.10
Rot. Bonds3

About 2-cyclopentyl-2-propylpyrrolidine

2-cyclopentyl-2-propylpyrrolidine (PubChem CID 66466252) has the molecular formula C12H23N and a molecular weight of 181.32 g/mol. Its IUPAC name is 2-cyclopentyl-2-propylpyrrolidine.

Molecular Properties

Compound Name2-cyclopentyl-2-propylpyrrolidine
PubChem CID66466252
Molecular FormulaC12H23N
Molecular Weight181.32 g/mol
Exact Mass181.18
IUPAC Name2-cyclopentyl-2-propylpyrrolidine
SMILESCCCC1(C2CCCC2)CCCN1
InChIInChI=1S/C12H23N/c1-2-8-12(9-5-10-13-12)11-6-3-4-7-11/h11,13H,2-10H2,1H3
InChIKeyJJZLDALNASHJLV-UHFFFAOYSA-N
XLogP3.10
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.32
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-2-propylpyrrolidine?
The IUPAC name of 2-cyclopentyl-2-propylpyrrolidine (CID 66466252) is 2-cyclopentyl-2-propylpyrrolidine.
What is the SMILES notation for 2-cyclopentyl-2-propylpyrrolidine?
The canonical SMILES for 2-cyclopentyl-2-propylpyrrolidine is CCCC1(C2CCCC2)CCCN1.
What is the InChIKey of 2-cyclopentyl-2-propylpyrrolidine?
The InChIKey is JJZLDALNASHJLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N/c1-2-8-12(9-5-10-13-12)11-6-3-4-7-11/h11,13H,2-10H2,1H3.
What are the key properties of 2-cyclopentyl-2-propylpyrrolidine?
2-cyclopentyl-2-propylpyrrolidine has a molecular weight of 181.32 g/mol, XLogP of 3.10, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-2-propylpyrrolidine is sourced from PubChem (CID 66466252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).