4-methyl-N-(4-methylpentan-2-yl)-4,5-dihydro-1,3-thiazol-2-amine

C10H20N2S — CID 43440172

IUPAC4-methyl-N-(4-methylpentan-2-yl)-4,5-dihydro-1,3-thiazol-2-amine
SMILESCC(C)CC(C)NC1=NC(C)CS1
InChIInChI=1S/C10H20N2S/c1-7(2)5-8(3)11-10-12-9(4)6-13-10/h7-9H,5-6H2,1-4H3,(H,11,12)
InChIKeyARMGJWDCHLACGK-UHFFFAOYSA-N
MW200.35 g/mol
LogP2.50
Rot. Bonds3

About 4-methyl-N-(4-methylpentan-2-yl)-4,5-dihydro-1,3-thiazol-2-amine

4-methyl-N-(4-methylpentan-2-yl)-4,5-dihydro-1,3-thiazol-2-amine (PubChem CID 43440172) has the molecular formula C10H20N2S and a molecular weight of 200.35 g/mol. Its IUPAC name is 4-methyl-N-(4-methylpentan-2-yl)-4,5-dihydro-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-methyl-N-(4-methylpentan-2-yl)-4,5-dihydro-1,3-thiazol-2-amine
PubChem CID43440172
Molecular FormulaC10H20N2S
Molecular Weight200.35 g/mol
Exact Mass200.13
IUPAC Name4-methyl-N-(4-methylpentan-2-yl)-4,5-dihydro-1,3-thiazol-2-amine
SMILESCC(C)CC(C)NC1=NC(C)CS1
InChIInChI=1S/C10H20N2S/c1-7(2)5-8(3)11-10-12-9(4)6-13-10/h7-9H,5-6H2,1-4H3,(H,11,12)
InChIKeyARMGJWDCHLACGK-UHFFFAOYSA-N
XLogP2.50
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.35
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-(4-methylpentan-2-yl)-4,5-dihydro-1,3-thiazol-2-amine?
The IUPAC name of 4-methyl-N-(4-methylpentan-2-yl)-4,5-dihydro-1,3-thiazol-2-amine (CID 43440172) is 4-methyl-N-(4-methylpentan-2-yl)-4,5-dihydro-1,3-thiazol-2-amine.
What is the SMILES notation for 4-methyl-N-(4-methylpentan-2-yl)-4,5-dihydro-1,3-thiazol-2-amine?
The canonical SMILES for 4-methyl-N-(4-methylpentan-2-yl)-4,5-dihydro-1,3-thiazol-2-amine is CC(C)CC(C)NC1=NC(C)CS1.
What is the InChIKey of 4-methyl-N-(4-methylpentan-2-yl)-4,5-dihydro-1,3-thiazol-2-amine?
The InChIKey is ARMGJWDCHLACGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2S/c1-7(2)5-8(3)11-10-12-9(4)6-13-10/h7-9H,5-6H2,1-4H3,(H,11,12).
What are the key properties of 4-methyl-N-(4-methylpentan-2-yl)-4,5-dihydro-1,3-thiazol-2-amine?
4-methyl-N-(4-methylpentan-2-yl)-4,5-dihydro-1,3-thiazol-2-amine has a molecular weight of 200.35 g/mol, XLogP of 2.50, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-(4-methylpentan-2-yl)-4,5-dihydro-1,3-thiazol-2-amine is sourced from PubChem (CID 43440172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).