N-(1-methoxypropan-2-yl)-4-propan-2-yl-4,5-dihydro-1,3-thiazol-2-amine

C10H20N2OS — CID 107857625

IUPACN-(1-methoxypropan-2-yl)-4-propan-2-yl-4,5-dihydro-1,3-thiazol-2-amine
SMILESCOCC(C)NC1=NC(C(C)C)CS1
InChIInChI=1S/C10H20N2OS/c1-7(2)9-6-14-10(12-9)11-8(3)5-13-4/h7-9H,5-6H2,1-4H3,(H,11,12)
InChIKeyHHDCLKUNHLSJSI-UHFFFAOYSA-N
MW216.35 g/mol
LogP1.74
Rot. Bonds4

About N-(1-methoxypropan-2-yl)-4-propan-2-yl-4,5-dihydro-1,3-thiazol-2-amine

N-(1-methoxypropan-2-yl)-4-propan-2-yl-4,5-dihydro-1,3-thiazol-2-amine (PubChem CID 107857625) has the molecular formula C10H20N2OS and a molecular weight of 216.35 g/mol. Its IUPAC name is N-(1-methoxypropan-2-yl)-4-propan-2-yl-4,5-dihydro-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-(1-methoxypropan-2-yl)-4-propan-2-yl-4,5-dihydro-1,3-thiazol-2-amine
PubChem CID107857625
Molecular FormulaC10H20N2OS
Molecular Weight216.35 g/mol
Exact Mass216.13
IUPAC NameN-(1-methoxypropan-2-yl)-4-propan-2-yl-4,5-dihydro-1,3-thiazol-2-amine
SMILESCOCC(C)NC1=NC(C(C)C)CS1
InChIInChI=1S/C10H20N2OS/c1-7(2)9-6-14-10(12-9)11-8(3)5-13-4/h7-9H,5-6H2,1-4H3,(H,11,12)
InChIKeyHHDCLKUNHLSJSI-UHFFFAOYSA-N
XLogP1.74
TPSA33.62 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.35
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(1-methoxypropan-2-yl)-4-propan-2-yl-4,5-dihydro-1,3-thiazol-2-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 N-(1-methoxypropan-2-yl)-4-propan-2-yl-4,5-dihydro-1,3-thiazol-2-amine?
The IUPAC name of N-(1-methoxypropan-2-yl)-4-propan-2-yl-4,5-dihydro-1,3-thiazol-2-amine (CID 107857625) is N-(1-methoxypropan-2-yl)-4-propan-2-yl-4,5-dihydro-1,3-thiazol-2-amine.
What is the SMILES notation for N-(1-methoxypropan-2-yl)-4-propan-2-yl-4,5-dihydro-1,3-thiazol-2-amine?
The canonical SMILES for N-(1-methoxypropan-2-yl)-4-propan-2-yl-4,5-dihydro-1,3-thiazol-2-amine is COCC(C)NC1=NC(C(C)C)CS1.
What is the InChIKey of N-(1-methoxypropan-2-yl)-4-propan-2-yl-4,5-dihydro-1,3-thiazol-2-amine?
The InChIKey is HHDCLKUNHLSJSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2OS/c1-7(2)9-6-14-10(12-9)11-8(3)5-13-4/h7-9H,5-6H2,1-4H3,(H,11,12).
What are the key properties of N-(1-methoxypropan-2-yl)-4-propan-2-yl-4,5-dihydro-1,3-thiazol-2-amine?
N-(1-methoxypropan-2-yl)-4-propan-2-yl-4,5-dihydro-1,3-thiazol-2-amine has a molecular weight of 216.35 g/mol, XLogP of 1.74, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methoxypropan-2-yl)-4-propan-2-yl-4,5-dihydro-1,3-thiazol-2-amine is sourced from PubChem (CID 107857625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).