1-[2-cyclopropyl-2-(propylamino)ethyl]-N,N,4-trimethylpyrrolidin-3-amine

C15H31N3 — CID 81463979

IUPAC1-[2-cyclopropyl-2-(propylamino)ethyl]-N,N,4-trimethylpyrrolidin-3-amine
SMILESCCCNC(CN1CC(C)C(N(C)C)C1)C1CC1
InChIInChI=1S/C15H31N3/c1-5-8-16-14(13-6-7-13)10-18-9-12(2)15(11-18)17(3)4/h12-16H,5-11H2,1-4H3
InChIKeyVEZDOPLSMYEHRY-UHFFFAOYSA-N
MW253.43 g/mol
LogP1.65
Rot. Bonds7

About 1-[2-cyclopropyl-2-(propylamino)ethyl]-N,N,4-trimethylpyrrolidin-3-amine

1-[2-cyclopropyl-2-(propylamino)ethyl]-N,N,4-trimethylpyrrolidin-3-amine (PubChem CID 81463979) has the molecular formula C15H31N3 and a molecular weight of 253.43 g/mol. Its IUPAC name is 1-[2-cyclopropyl-2-(propylamino)ethyl]-N,N,4-trimethylpyrrolidin-3-amine.

Molecular Properties

Compound Name1-[2-cyclopropyl-2-(propylamino)ethyl]-N,N,4-trimethylpyrrolidin-3-amine
PubChem CID81463979
Molecular FormulaC15H31N3
Molecular Weight253.43 g/mol
Exact Mass253.25
IUPAC Name1-[2-cyclopropyl-2-(propylamino)ethyl]-N,N,4-trimethylpyrrolidin-3-amine
SMILESCCCNC(CN1CC(C)C(N(C)C)C1)C1CC1
InChIInChI=1S/C15H31N3/c1-5-8-16-14(13-6-7-13)10-18-9-12(2)15(11-18)17(3)4/h12-16H,5-11H2,1-4H3
InChIKeyVEZDOPLSMYEHRY-UHFFFAOYSA-N
XLogP1.65
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
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-cyclopropyl-2-(propylamino)ethyl]-N,N,4-trimethylpyrrolidin-3-amine?
The IUPAC name of 1-[2-cyclopropyl-2-(propylamino)ethyl]-N,N,4-trimethylpyrrolidin-3-amine (CID 81463979) is 1-[2-cyclopropyl-2-(propylamino)ethyl]-N,N,4-trimethylpyrrolidin-3-amine.
What is the SMILES notation for 1-[2-cyclopropyl-2-(propylamino)ethyl]-N,N,4-trimethylpyrrolidin-3-amine?
The canonical SMILES for 1-[2-cyclopropyl-2-(propylamino)ethyl]-N,N,4-trimethylpyrrolidin-3-amine is CCCNC(CN1CC(C)C(N(C)C)C1)C1CC1.
What is the InChIKey of 1-[2-cyclopropyl-2-(propylamino)ethyl]-N,N,4-trimethylpyrrolidin-3-amine?
The InChIKey is VEZDOPLSMYEHRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N3/c1-5-8-16-14(13-6-7-13)10-18-9-12(2)15(11-18)17(3)4/h12-16H,5-11H2,1-4H3.
What are the key properties of 1-[2-cyclopropyl-2-(propylamino)ethyl]-N,N,4-trimethylpyrrolidin-3-amine?
1-[2-cyclopropyl-2-(propylamino)ethyl]-N,N,4-trimethylpyrrolidin-3-amine has a molecular weight of 253.43 g/mol, XLogP of 1.65, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-cyclopropyl-2-(propylamino)ethyl]-N,N,4-trimethylpyrrolidin-3-amine is sourced from PubChem (CID 81463979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).