4-ethyl-2-[(3R)-3-methoxypyrrolidin-1-yl]-1,3-thiazole

C10H16N2OS — CID 70954993

IUPAC4-ethyl-2-[(3R)-3-methoxypyrrolidin-1-yl]-1,3-thiazole
SMILESCCc1csc(N2CC[C@@H](OC)C2)n1
InChIInChI=1S/C10H16N2OS/c1-3-8-7-14-10(11-8)12-5-4-9(6-12)13-2/h7,9H,3-6H2,1-2H3/t9-/m1/s1
InChIKeyFOOOARXRSHIJSF-SECBINFHSA-N
MW212.32 g/mol
LogP1.93
Rot. Bonds3

About 4-ethyl-2-[(3R)-3-methoxypyrrolidin-1-yl]-1,3-thiazole

4-ethyl-2-[(3R)-3-methoxypyrrolidin-1-yl]-1,3-thiazole (PubChem CID 70954993) has the molecular formula C10H16N2OS and a molecular weight of 212.32 g/mol. Its IUPAC name is 4-ethyl-2-[(3R)-3-methoxypyrrolidin-1-yl]-1,3-thiazole.

Molecular Properties

Compound Name4-ethyl-2-[(3R)-3-methoxypyrrolidin-1-yl]-1,3-thiazole
PubChem CID70954993
Molecular FormulaC10H16N2OS
Molecular Weight212.32 g/mol
Exact Mass212.10
IUPAC Name4-ethyl-2-[(3R)-3-methoxypyrrolidin-1-yl]-1,3-thiazole
SMILESCCc1csc(N2CC[C@@H](OC)C2)n1
InChIInChI=1S/C10H16N2OS/c1-3-8-7-14-10(11-8)12-5-4-9(6-12)13-2/h7,9H,3-6H2,1-2H3/t9-/m1/s1
InChIKeyFOOOARXRSHIJSF-SECBINFHSA-N
XLogP1.93
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.32
LogP ≤ 51.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 4-ethyl-2-[(3R)-3-methoxypyrrolidin-1-yl]-1,3-thiazole 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 4-ethyl-2-[(3R)-3-methoxypyrrolidin-1-yl]-1,3-thiazole?
The IUPAC name of 4-ethyl-2-[(3R)-3-methoxypyrrolidin-1-yl]-1,3-thiazole (CID 70954993) is 4-ethyl-2-[(3R)-3-methoxypyrrolidin-1-yl]-1,3-thiazole.
What is the SMILES notation for 4-ethyl-2-[(3R)-3-methoxypyrrolidin-1-yl]-1,3-thiazole?
The canonical SMILES for 4-ethyl-2-[(3R)-3-methoxypyrrolidin-1-yl]-1,3-thiazole is CCc1csc(N2CC[C@@H](OC)C2)n1.
What is the InChIKey of 4-ethyl-2-[(3R)-3-methoxypyrrolidin-1-yl]-1,3-thiazole?
The InChIKey is FOOOARXRSHIJSF-SECBINFHSA-N. The full InChI is InChI=1S/C10H16N2OS/c1-3-8-7-14-10(11-8)12-5-4-9(6-12)13-2/h7,9H,3-6H2,1-2H3/t9-/m1/s1.
What are the key properties of 4-ethyl-2-[(3R)-3-methoxypyrrolidin-1-yl]-1,3-thiazole?
4-ethyl-2-[(3R)-3-methoxypyrrolidin-1-yl]-1,3-thiazole has a molecular weight of 212.32 g/mol, XLogP of 1.93, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-2-[(3R)-3-methoxypyrrolidin-1-yl]-1,3-thiazole is sourced from PubChem (CID 70954993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).