1-[2-cyclopentyl-2-(methylamino)ethyl]-N,N,4-trimethylpyrrolidin-3-amine

C15H31N3 — CID 113448343

IUPAC1-[2-cyclopentyl-2-(methylamino)ethyl]-N,N,4-trimethylpyrrolidin-3-amine
SMILESCNC(CN1CC(C)C(N(C)C)C1)C1CCCC1
InChIInChI=1S/C15H31N3/c1-12-9-18(11-15(12)17(3)4)10-14(16-2)13-7-5-6-8-13/h12-16H,5-11H2,1-4H3
InChIKeyBPEWSZORCDGLNH-UHFFFAOYSA-N
MW253.43 g/mol
LogP1.65
Rot. Bonds5

About 1-[2-cyclopentyl-2-(methylamino)ethyl]-N,N,4-trimethylpyrrolidin-3-amine

1-[2-cyclopentyl-2-(methylamino)ethyl]-N,N,4-trimethylpyrrolidin-3-amine (PubChem CID 113448343) has the molecular formula C15H31N3 and a molecular weight of 253.43 g/mol. Its IUPAC name is 1-[2-cyclopentyl-2-(methylamino)ethyl]-N,N,4-trimethylpyrrolidin-3-amine.

Molecular Properties

Compound Name1-[2-cyclopentyl-2-(methylamino)ethyl]-N,N,4-trimethylpyrrolidin-3-amine
PubChem CID113448343
Molecular FormulaC15H31N3
Molecular Weight253.43 g/mol
Exact Mass253.25
IUPAC Name1-[2-cyclopentyl-2-(methylamino)ethyl]-N,N,4-trimethylpyrrolidin-3-amine
SMILESCNC(CN1CC(C)C(N(C)C)C1)C1CCCC1
InChIInChI=1S/C15H31N3/c1-12-9-18(11-15(12)17(3)4)10-14(16-2)13-7-5-6-8-13/h12-16H,5-11H2,1-4H3
InChIKeyBPEWSZORCDGLNH-UHFFFAOYSA-N
XLogP1.65
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.43
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[2-cyclopentyl-2-(methylamino)ethyl]-N,N,4-trimethylpyrrolidin-3-amine?
The IUPAC name of 1-[2-cyclopentyl-2-(methylamino)ethyl]-N,N,4-trimethylpyrrolidin-3-amine (CID 113448343) is 1-[2-cyclopentyl-2-(methylamino)ethyl]-N,N,4-trimethylpyrrolidin-3-amine.
What is the SMILES notation for 1-[2-cyclopentyl-2-(methylamino)ethyl]-N,N,4-trimethylpyrrolidin-3-amine?
The canonical SMILES for 1-[2-cyclopentyl-2-(methylamino)ethyl]-N,N,4-trimethylpyrrolidin-3-amine is CNC(CN1CC(C)C(N(C)C)C1)C1CCCC1.
What is the InChIKey of 1-[2-cyclopentyl-2-(methylamino)ethyl]-N,N,4-trimethylpyrrolidin-3-amine?
The InChIKey is BPEWSZORCDGLNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N3/c1-12-9-18(11-15(12)17(3)4)10-14(16-2)13-7-5-6-8-13/h12-16H,5-11H2,1-4H3.
What are the key properties of 1-[2-cyclopentyl-2-(methylamino)ethyl]-N,N,4-trimethylpyrrolidin-3-amine?
1-[2-cyclopentyl-2-(methylamino)ethyl]-N,N,4-trimethylpyrrolidin-3-amine has a molecular weight of 253.43 g/mol, XLogP of 1.65, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-cyclopentyl-2-(methylamino)ethyl]-N,N,4-trimethylpyrrolidin-3-amine is sourced from PubChem (CID 113448343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).