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

C9H17N3S — CID 61465307

IUPAC5-methyl-N-(1-methylpyrrolidin-3-yl)-4,5-dihydro-1,3-thiazol-2-amine
SMILESCC1CN=C(NC2CCN(C)C2)S1
InChIInChI=1S/C9H17N3S/c1-7-5-10-9(13-7)11-8-3-4-12(2)6-8/h7-8H,3-6H2,1-2H3,(H,10,11)
InChIKeyKBXXFWWKCOYBJO-UHFFFAOYSA-N
MW199.32 g/mol
LogP0.77
Rot. Bonds1

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

5-methyl-N-(1-methylpyrrolidin-3-yl)-4,5-dihydro-1,3-thiazol-2-amine (PubChem CID 61465307) has the molecular formula C9H17N3S and a molecular weight of 199.32 g/mol. Its IUPAC name is 5-methyl-N-(1-methylpyrrolidin-3-yl)-4,5-dihydro-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-methyl-N-(1-methylpyrrolidin-3-yl)-4,5-dihydro-1,3-thiazol-2-amine
PubChem CID61465307
Molecular FormulaC9H17N3S
Molecular Weight199.32 g/mol
Exact Mass199.11
IUPAC Name5-methyl-N-(1-methylpyrrolidin-3-yl)-4,5-dihydro-1,3-thiazol-2-amine
SMILESCC1CN=C(NC2CCN(C)C2)S1
InChIInChI=1S/C9H17N3S/c1-7-5-10-9(13-7)11-8-3-4-12(2)6-8/h7-8H,3-6H2,1-2H3,(H,10,11)
InChIKeyKBXXFWWKCOYBJO-UHFFFAOYSA-N
XLogP0.77
TPSA27.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.32
LogP ≤ 50.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-methyl-N-(1-methylpyrrolidin-3-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 5-methyl-N-(1-methylpyrrolidin-3-yl)-4,5-dihydro-1,3-thiazol-2-amine?
The IUPAC name of 5-methyl-N-(1-methylpyrrolidin-3-yl)-4,5-dihydro-1,3-thiazol-2-amine (CID 61465307) is 5-methyl-N-(1-methylpyrrolidin-3-yl)-4,5-dihydro-1,3-thiazol-2-amine.
What is the SMILES notation for 5-methyl-N-(1-methylpyrrolidin-3-yl)-4,5-dihydro-1,3-thiazol-2-amine?
The canonical SMILES for 5-methyl-N-(1-methylpyrrolidin-3-yl)-4,5-dihydro-1,3-thiazol-2-amine is CC1CN=C(NC2CCN(C)C2)S1.
What is the InChIKey of 5-methyl-N-(1-methylpyrrolidin-3-yl)-4,5-dihydro-1,3-thiazol-2-amine?
The InChIKey is KBXXFWWKCOYBJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N3S/c1-7-5-10-9(13-7)11-8-3-4-12(2)6-8/h7-8H,3-6H2,1-2H3,(H,10,11).
What are the key properties of 5-methyl-N-(1-methylpyrrolidin-3-yl)-4,5-dihydro-1,3-thiazol-2-amine?
5-methyl-N-(1-methylpyrrolidin-3-yl)-4,5-dihydro-1,3-thiazol-2-amine has a molecular weight of 199.32 g/mol, XLogP of 0.77, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-(1-methylpyrrolidin-3-yl)-4,5-dihydro-1,3-thiazol-2-amine is sourced from PubChem (CID 61465307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).