2-(2-ethylbutyl)-2-propan-2-ylpyrrolidine

C13H27N — CID 82922353

IUPAC2-(2-ethylbutyl)-2-propan-2-ylpyrrolidine
SMILESCCC(CC)CC1(C(C)C)CCCN1
InChIInChI=1S/C13H27N/c1-5-12(6-2)10-13(11(3)4)8-7-9-14-13/h11-12,14H,5-10H2,1-4H3
InChIKeyWGLXHISDMNKNAP-UHFFFAOYSA-N
MW197.37 g/mol
LogP3.59
Rot. Bonds5

About 2-(2-ethylbutyl)-2-propan-2-ylpyrrolidine

2-(2-ethylbutyl)-2-propan-2-ylpyrrolidine (PubChem CID 82922353) has the molecular formula C13H27N and a molecular weight of 197.37 g/mol. Its IUPAC name is 2-(2-ethylbutyl)-2-propan-2-ylpyrrolidine.

Molecular Properties

Compound Name2-(2-ethylbutyl)-2-propan-2-ylpyrrolidine
PubChem CID82922353
Molecular FormulaC13H27N
Molecular Weight197.37 g/mol
Exact Mass197.21
IUPAC Name2-(2-ethylbutyl)-2-propan-2-ylpyrrolidine
SMILESCCC(CC)CC1(C(C)C)CCCN1
InChIInChI=1S/C13H27N/c1-5-12(6-2)10-13(11(3)4)8-7-9-14-13/h11-12,14H,5-10H2,1-4H3
InChIKeyWGLXHISDMNKNAP-UHFFFAOYSA-N
XLogP3.59
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.37
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(2-methylpropyl)-2-propan-2-ylazepane
CID 79119427
(2-propan-2-ylpyrrolidin-2-yl)methanol
CID 84648893
2-ethyl-2-propan-2-ylazepane
CID 79117006
N,N-dimethyl-1-(2-propan-2-ylpyrrolidin-2-yl)methanamine
CID 117271095
2-dodecyl-2-propan-2-ylpyrrolidine
CID 66468316
2-butan-2-yl-2-propylpyrrolidine
CID 79443895
2-(2-methylpropyl)-2-pentan-2-ylpyrrolidine
CID 107896608
2-pentyl-2-propan-2-ylazepane
CID 79119110
2-benzyl-2-propan-2-ylpyrrolidine
CID 66466509
2-butan-2-yl-2-propan-2-ylpyrrolidine
CID 79444154
2-propan-2-yl-2-(propan-2-yloxymethyl)azepane
CID 79569057
2-(2-methoxyethyl)-2-propan-2-ylpiperidine
CID 117271109

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethylbutyl)-2-propan-2-ylpyrrolidine?
The IUPAC name of 2-(2-ethylbutyl)-2-propan-2-ylpyrrolidine (CID 82922353) is 2-(2-ethylbutyl)-2-propan-2-ylpyrrolidine.
What is the SMILES notation for 2-(2-ethylbutyl)-2-propan-2-ylpyrrolidine?
The canonical SMILES for 2-(2-ethylbutyl)-2-propan-2-ylpyrrolidine is CCC(CC)CC1(C(C)C)CCCN1.
What is the InChIKey of 2-(2-ethylbutyl)-2-propan-2-ylpyrrolidine?
The InChIKey is WGLXHISDMNKNAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N/c1-5-12(6-2)10-13(11(3)4)8-7-9-14-13/h11-12,14H,5-10H2,1-4H3.
What are the key properties of 2-(2-ethylbutyl)-2-propan-2-ylpyrrolidine?
2-(2-ethylbutyl)-2-propan-2-ylpyrrolidine has a molecular weight of 197.37 g/mol, XLogP of 3.59, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethylbutyl)-2-propan-2-ylpyrrolidine is sourced from PubChem (CID 82922353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).