2-N-(3-methoxy-2-methylpropyl)-1,3-thiazole-2,5-diamine

C8H15N3OS — CID 102768192

IUPAC2-N-(3-methoxy-2-methylpropyl)-1,3-thiazole-2,5-diamine
SMILESCOCC(C)CNc1ncc(N)s1
InChIInChI=1S/C8H15N3OS/c1-6(5-12-2)3-10-8-11-4-7(9)13-8/h4,6H,3,5,9H2,1-2H3,(H,10,11)
InChIKeyOUIWGERGNQKFGT-UHFFFAOYSA-N
MW201.29 g/mol
LogP1.42
Rot. Bonds5

About 2-N-(3-methoxy-2-methylpropyl)-1,3-thiazole-2,5-diamine

2-N-(3-methoxy-2-methylpropyl)-1,3-thiazole-2,5-diamine (PubChem CID 102768192) has the molecular formula C8H15N3OS and a molecular weight of 201.29 g/mol. Its IUPAC name is 2-N-(3-methoxy-2-methylpropyl)-1,3-thiazole-2,5-diamine.

Molecular Properties

Compound Name2-N-(3-methoxy-2-methylpropyl)-1,3-thiazole-2,5-diamine
PubChem CID102768192
Molecular FormulaC8H15N3OS
Molecular Weight201.29 g/mol
Exact Mass201.09
IUPAC Name2-N-(3-methoxy-2-methylpropyl)-1,3-thiazole-2,5-diamine
SMILESCOCC(C)CNc1ncc(N)s1
InChIInChI=1S/C8H15N3OS/c1-6(5-12-2)3-10-8-11-4-7(9)13-8/h4,6H,3,5,9H2,1-2H3,(H,10,11)
InChIKeyOUIWGERGNQKFGT-UHFFFAOYSA-N
XLogP1.42
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.29
LogP ≤ 51.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-N-(3-methoxy-2-methylpropyl)-1,3-thiazole-2,5-diamine 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 2-N-(3-methoxy-2-methylpropyl)-1,3-thiazole-2,5-diamine?
The IUPAC name of 2-N-(3-methoxy-2-methylpropyl)-1,3-thiazole-2,5-diamine (CID 102768192) is 2-N-(3-methoxy-2-methylpropyl)-1,3-thiazole-2,5-diamine.
What is the SMILES notation for 2-N-(3-methoxy-2-methylpropyl)-1,3-thiazole-2,5-diamine?
The canonical SMILES for 2-N-(3-methoxy-2-methylpropyl)-1,3-thiazole-2,5-diamine is COCC(C)CNc1ncc(N)s1.
What is the InChIKey of 2-N-(3-methoxy-2-methylpropyl)-1,3-thiazole-2,5-diamine?
The InChIKey is OUIWGERGNQKFGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N3OS/c1-6(5-12-2)3-10-8-11-4-7(9)13-8/h4,6H,3,5,9H2,1-2H3,(H,10,11).
What are the key properties of 2-N-(3-methoxy-2-methylpropyl)-1,3-thiazole-2,5-diamine?
2-N-(3-methoxy-2-methylpropyl)-1,3-thiazole-2,5-diamine has a molecular weight of 201.29 g/mol, XLogP of 1.42, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(3-methoxy-2-methylpropyl)-1,3-thiazole-2,5-diamine is sourced from PubChem (CID 102768192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).