2-cyclopropyl-2-pentan-2-ylpyrrolidine

C12H23N — CID 107896605

IUPAC2-cyclopropyl-2-pentan-2-ylpyrrolidine
SMILESCCCC(C)C1(C2CC2)CCCN1
InChIInChI=1S/C12H23N/c1-3-5-10(2)12(11-6-7-11)8-4-9-13-12/h10-11,13H,3-9H2,1-2H3
InChIKeyMLBRZZPFOADWJC-UHFFFAOYSA-N
MW181.32 g/mol
LogP2.95
Rot. Bonds4

About 2-cyclopropyl-2-pentan-2-ylpyrrolidine

2-cyclopropyl-2-pentan-2-ylpyrrolidine (PubChem CID 107896605) has the molecular formula C12H23N and a molecular weight of 181.32 g/mol. Its IUPAC name is 2-cyclopropyl-2-pentan-2-ylpyrrolidine.

Molecular Properties

Compound Name2-cyclopropyl-2-pentan-2-ylpyrrolidine
PubChem CID107896605
Molecular FormulaC12H23N
Molecular Weight181.32 g/mol
Exact Mass181.18
IUPAC Name2-cyclopropyl-2-pentan-2-ylpyrrolidine
SMILESCCCC(C)C1(C2CC2)CCCN1
InChIInChI=1S/C12H23N/c1-3-5-10(2)12(11-6-7-11)8-4-9-13-12/h10-11,13H,3-9H2,1-2H3
InChIKeyMLBRZZPFOADWJC-UHFFFAOYSA-N
XLogP2.95
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.32
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(4-methylcyclohexyl)-2-propan-2-ylazepane
CID 79118380
1-methyl-3-(2-propan-2-ylpyrrolidin-2-yl)pyrrolidine
CID 117270918
2-(2-methylpropyl)-2-pentan-2-ylpyrrolidine
CID 107896608
2-cyclopropyl-2-(2-methylpentyl)azepane
CID 79116467
2-cyclopropyl-2-(2-methylbutyl)pyrrolidine
CID 66466256
1-pentan-2-ylbicyclo[3.1.0]hexane
CID 147905312
2-ethyl-2-(2-methylpentyl)pyrrolidine
CID 66466921
4-cyclohexyl-4-pentan-2-ylcyclohexan-1-one
CID 45073577
2-(2-ethylcyclohexyl)-2-propan-2-ylazepane
CID 79118036
2-pentan-2-ylbicyclo[2.2.1]heptan-2-amine
CID 107898475
1-methyl-1-pentan-2-ylcyclopropane
CID 57204658
2-cyclopentyl-2-propylpyrrolidine
CID 66466252

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-2-pentan-2-ylpyrrolidine?
The IUPAC name of 2-cyclopropyl-2-pentan-2-ylpyrrolidine (CID 107896605) is 2-cyclopropyl-2-pentan-2-ylpyrrolidine.
What is the SMILES notation for 2-cyclopropyl-2-pentan-2-ylpyrrolidine?
The canonical SMILES for 2-cyclopropyl-2-pentan-2-ylpyrrolidine is CCCC(C)C1(C2CC2)CCCN1.
What is the InChIKey of 2-cyclopropyl-2-pentan-2-ylpyrrolidine?
The InChIKey is MLBRZZPFOADWJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N/c1-3-5-10(2)12(11-6-7-11)8-4-9-13-12/h10-11,13H,3-9H2,1-2H3.
What are the key properties of 2-cyclopropyl-2-pentan-2-ylpyrrolidine?
2-cyclopropyl-2-pentan-2-ylpyrrolidine has a molecular weight of 181.32 g/mol, XLogP of 2.95, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-2-pentan-2-ylpyrrolidine is sourced from PubChem (CID 107896605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).