(2R)-2-ethyl-1-propan-2-ylazetidine;(2S)-2-ethyl-1-propan-2-ylazetidine;(3R)-3-methyl-1-propan-2-ylpyrrolidine;(3S)-3-methyl-1-propan-2-ylpyrrolidine

C32H68N4 — CID 157264847

IUPAC(2R)-2-ethyl-1-propan-2-ylazetidine;(2S)-2-ethyl-1-propan-2-ylazetidine;(3R)-3-methyl-1-propan-2-ylpyrrolidine;(3S)-3-methyl-1-propan-2-ylpyrrolidine
SMILESCC(C)N1CC[C@@H](C)C1.CC(C)N1CC[C@H](C)C1.CC[C@@H]1CCN1C(C)C.CC[C@H]1CCN1C(C)C
InChIInChI=1S/4C8H17N/c2*1-7(2)9-5-4-8(3)6-9;2*1-4-8-5-6-9(8)7(2)3/h4*7-8H,4-6H2,1-3H3/t4*8-/m1010/s1
InChIKeyAXWMLCGIRQAYIS-FTANDVATSA-N
MW508.92 g/mol
LogP7.23
Rot. Bonds6

About (2R)-2-ethyl-1-propan-2-ylazetidine;(2S)-2-ethyl-1-propan-2-ylazetidine;(3R)-3-methyl-1-propan-2-ylpyrrolidine;(3S)-3-methyl-1-propan-2-ylpyrrolidine

(2R)-2-ethyl-1-propan-2-ylazetidine;(2S)-2-ethyl-1-propan-2-ylazetidine;(3R)-3-methyl-1-propan-2-ylpyrrolidine;(3S)-3-methyl-1-propan-2-ylpyrrolidine (PubChem CID 157264847) has the molecular formula C32H68N4 and a molecular weight of 508.92 g/mol. Its IUPAC name is (2R)-2-ethyl-1-propan-2-ylazetidine;(2S)-2-ethyl-1-propan-2-ylazetidine;(3R)-3-methyl-1-propan-2-ylpyrrolidine;(3S)-3-methyl-1-propan-2-ylpyrrolidine.

Molecular Properties

Compound Name(2R)-2-ethyl-1-propan-2-ylazetidine;(2S)-2-ethyl-1-propan-2-ylazetidine;(3R)-3-methyl-1-propan-2-ylpyrrolidine;(3S)-3-methyl-1-propan-2-ylpyrrolidine
PubChem CID157264847
Molecular FormulaC32H68N4
Molecular Weight508.92 g/mol
Exact Mass508.54
IUPAC Name(2R)-2-ethyl-1-propan-2-ylazetidine;(2S)-2-ethyl-1-propan-2-ylazetidine;(3R)-3-methyl-1-propan-2-ylpyrrolidine;(3S)-3-methyl-1-propan-2-ylpyrrolidine
SMILESCC(C)N1CC[C@@H](C)C1.CC(C)N1CC[C@H](C)C1.CC[C@@H]1CCN1C(C)C.CC[C@H]1CCN1C(C)C
InChIInChI=1S/4C8H17N/c2*1-7(2)9-5-4-8(3)6-9;2*1-4-8-5-6-9(8)7(2)3/h4*7-8H,4-6H2,1-3H3/t4*8-/m1010/s1
InChIKeyAXWMLCGIRQAYIS-FTANDVATSA-N
XLogP7.23
TPSA12.96 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms36
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500508.92
LogP ≤ 57.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze (2R)-2-ethyl-1-propan-2-ylazetidine;(2S)-2-ethyl-1-propan-2-ylazetidine;(3R)-3-methyl-1-propan-2-ylpyrrolidine;(3S)-3-methyl-1-propan-2-ylpyrrolidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (2R)-2-ethyl-1-propan-2-ylazetidine;(2S)-2-ethyl-1-propan-2-ylazetidine;(3R)-3-methyl-1-propan-2-ylpyrrolidine;(3S)-3-methyl-1-propan-2-ylpyrrolidine?
The IUPAC name of (2R)-2-ethyl-1-propan-2-ylazetidine;(2S)-2-ethyl-1-propan-2-ylazetidine;(3R)-3-methyl-1-propan-2-ylpyrrolidine;(3S)-3-methyl-1-propan-2-ylpyrrolidine (CID 157264847) is (2R)-2-ethyl-1-propan-2-ylazetidine;(2S)-2-ethyl-1-propan-2-ylazetidine;(3R)-3-methyl-1-propan-2-ylpyrrolidine;(3S)-3-methyl-1-propan-2-ylpyrrolidine.
What is the SMILES notation for (2R)-2-ethyl-1-propan-2-ylazetidine;(2S)-2-ethyl-1-propan-2-ylazetidine;(3R)-3-methyl-1-propan-2-ylpyrrolidine;(3S)-3-methyl-1-propan-2-ylpyrrolidine?
The canonical SMILES for (2R)-2-ethyl-1-propan-2-ylazetidine;(2S)-2-ethyl-1-propan-2-ylazetidine;(3R)-3-methyl-1-propan-2-ylpyrrolidine;(3S)-3-methyl-1-propan-2-ylpyrrolidine is CC(C)N1CC[C@@H](C)C1.CC(C)N1CC[C@H](C)C1.CC[C@@H]1CCN1C(C)C.CC[C@H]1CCN1C(C)C.
What is the InChIKey of (2R)-2-ethyl-1-propan-2-ylazetidine;(2S)-2-ethyl-1-propan-2-ylazetidine;(3R)-3-methyl-1-propan-2-ylpyrrolidine;(3S)-3-methyl-1-propan-2-ylpyrrolidine?
The InChIKey is AXWMLCGIRQAYIS-FTANDVATSA-N. The full InChI is InChI=1S/4C8H17N/c2*1-7(2)9-5-4-8(3)6-9;2*1-4-8-5-6-9(8)7(2)3/h4*7-8H,4-6H2,1-3H3/t4*8-/m1010/s1.
What are the key properties of (2R)-2-ethyl-1-propan-2-ylazetidine;(2S)-2-ethyl-1-propan-2-ylazetidine;(3R)-3-methyl-1-propan-2-ylpyrrolidine;(3S)-3-methyl-1-propan-2-ylpyrrolidine?
(2R)-2-ethyl-1-propan-2-ylazetidine;(2S)-2-ethyl-1-propan-2-ylazetidine;(3R)-3-methyl-1-propan-2-ylpyrrolidine;(3S)-3-methyl-1-propan-2-ylpyrrolidine has a molecular weight of 508.92 g/mol, XLogP of 7.23, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-ethyl-1-propan-2-ylazetidine;(2S)-2-ethyl-1-propan-2-ylazetidine;(3R)-3-methyl-1-propan-2-ylpyrrolidine;(3S)-3-methyl-1-propan-2-ylpyrrolidine is sourced from PubChem (CID 157264847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).