5-(3,3-diethylpyrrolidin-1-yl)-4-propan-2-yloxy-1,2-thiazol-3-amine

C14H25N3OS — CID 103364562

IUPAC5-(3,3-diethylpyrrolidin-1-yl)-4-propan-2-yloxy-1,2-thiazol-3-amine
SMILESCCC1(CC)CCN(c2snc(N)c2OC(C)C)C1
InChIInChI=1S/C14H25N3OS/c1-5-14(6-2)7-8-17(9-14)13-11(18-10(3)4)12(15)16-19-13/h10H,5-9H2,1-4H3,(H2,15,16)
InChIKeyWPUNJULXVSWVMR-UHFFFAOYSA-N
MW283.44 g/mol
LogP3.53
Rot. Bonds5

About 5-(3,3-diethylpyrrolidin-1-yl)-4-propan-2-yloxy-1,2-thiazol-3-amine

5-(3,3-diethylpyrrolidin-1-yl)-4-propan-2-yloxy-1,2-thiazol-3-amine (PubChem CID 103364562) has the molecular formula C14H25N3OS and a molecular weight of 283.44 g/mol. Its IUPAC name is 5-(3,3-diethylpyrrolidin-1-yl)-4-propan-2-yloxy-1,2-thiazol-3-amine.

Molecular Properties

Compound Name5-(3,3-diethylpyrrolidin-1-yl)-4-propan-2-yloxy-1,2-thiazol-3-amine
PubChem CID103364562
Molecular FormulaC14H25N3OS
Molecular Weight283.44 g/mol
Exact Mass283.17
IUPAC Name5-(3,3-diethylpyrrolidin-1-yl)-4-propan-2-yloxy-1,2-thiazol-3-amine
SMILESCCC1(CC)CCN(c2snc(N)c2OC(C)C)C1
InChIInChI=1S/C14H25N3OS/c1-5-14(6-2)7-8-17(9-14)13-11(18-10(3)4)12(15)16-19-13/h10H,5-9H2,1-4H3,(H2,15,16)
InChIKeyWPUNJULXVSWVMR-UHFFFAOYSA-N
XLogP3.53
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.44
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 5-(3,3-diethylpyrrolidin-1-yl)-4-propan-2-yloxy-1,2-thiazol-3-amine 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 5-(3,3-diethylpyrrolidin-1-yl)-4-propan-2-yloxy-1,2-thiazol-3-amine?
The IUPAC name of 5-(3,3-diethylpyrrolidin-1-yl)-4-propan-2-yloxy-1,2-thiazol-3-amine (CID 103364562) is 5-(3,3-diethylpyrrolidin-1-yl)-4-propan-2-yloxy-1,2-thiazol-3-amine.
What is the SMILES notation for 5-(3,3-diethylpyrrolidin-1-yl)-4-propan-2-yloxy-1,2-thiazol-3-amine?
The canonical SMILES for 5-(3,3-diethylpyrrolidin-1-yl)-4-propan-2-yloxy-1,2-thiazol-3-amine is CCC1(CC)CCN(c2snc(N)c2OC(C)C)C1.
What is the InChIKey of 5-(3,3-diethylpyrrolidin-1-yl)-4-propan-2-yloxy-1,2-thiazol-3-amine?
The InChIKey is WPUNJULXVSWVMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3OS/c1-5-14(6-2)7-8-17(9-14)13-11(18-10(3)4)12(15)16-19-13/h10H,5-9H2,1-4H3,(H2,15,16).
What are the key properties of 5-(3,3-diethylpyrrolidin-1-yl)-4-propan-2-yloxy-1,2-thiazol-3-amine?
5-(3,3-diethylpyrrolidin-1-yl)-4-propan-2-yloxy-1,2-thiazol-3-amine has a molecular weight of 283.44 g/mol, XLogP of 3.53, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3,3-diethylpyrrolidin-1-yl)-4-propan-2-yloxy-1,2-thiazol-3-amine is sourced from PubChem (CID 103364562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).