5-[3-(dimethylamino)propyl]-4,6-dihydropyrrolo[3,4-d][1,3]thiazol-2-amine

C10H18N4S — CID 82194316

IUPAC5-[3-(dimethylamino)propyl]-4,6-dihydropyrrolo[3,4-d][1,3]thiazol-2-amine
SMILESCN(C)CCCN1Cc2nc(N)sc2C1
InChIInChI=1S/C10H18N4S/c1-13(2)4-3-5-14-6-8-9(7-14)15-10(11)12-8/h3-7H2,1-2H3,(H2,11,12)
InChIKeyRITCJGWRYRCYLR-UHFFFAOYSA-N
MW226.35 g/mol
LogP0.99
Rot. Bonds4

About 5-[3-(dimethylamino)propyl]-4,6-dihydropyrrolo[3,4-d][1,3]thiazol-2-amine

5-[3-(dimethylamino)propyl]-4,6-dihydropyrrolo[3,4-d][1,3]thiazol-2-amine (PubChem CID 82194316) has the molecular formula C10H18N4S and a molecular weight of 226.35 g/mol. Its IUPAC name is 5-[3-(dimethylamino)propyl]-4,6-dihydropyrrolo[3,4-d][1,3]thiazol-2-amine.

Molecular Properties

Compound Name5-[3-(dimethylamino)propyl]-4,6-dihydropyrrolo[3,4-d][1,3]thiazol-2-amine
PubChem CID82194316
Molecular FormulaC10H18N4S
Molecular Weight226.35 g/mol
Exact Mass226.13
IUPAC Name5-[3-(dimethylamino)propyl]-4,6-dihydropyrrolo[3,4-d][1,3]thiazol-2-amine
SMILESCN(C)CCCN1Cc2nc(N)sc2C1
InChIInChI=1S/C10H18N4S/c1-13(2)4-3-5-14-6-8-9(7-14)15-10(11)12-8/h3-7H2,1-2H3,(H2,11,12)
InChIKeyRITCJGWRYRCYLR-UHFFFAOYSA-N
XLogP0.99
TPSA45.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.35
LogP ≤ 50.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 5-[3-(dimethylamino)propyl]-4,6-dihydropyrrolo[3,4-d][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-[3-(dimethylamino)propyl]-4,6-dihydropyrrolo[3,4-d][1,3]thiazol-2-amine?
The IUPAC name of 5-[3-(dimethylamino)propyl]-4,6-dihydropyrrolo[3,4-d][1,3]thiazol-2-amine (CID 82194316) is 5-[3-(dimethylamino)propyl]-4,6-dihydropyrrolo[3,4-d][1,3]thiazol-2-amine.
What is the SMILES notation for 5-[3-(dimethylamino)propyl]-4,6-dihydropyrrolo[3,4-d][1,3]thiazol-2-amine?
The canonical SMILES for 5-[3-(dimethylamino)propyl]-4,6-dihydropyrrolo[3,4-d][1,3]thiazol-2-amine is CN(C)CCCN1Cc2nc(N)sc2C1.
What is the InChIKey of 5-[3-(dimethylamino)propyl]-4,6-dihydropyrrolo[3,4-d][1,3]thiazol-2-amine?
The InChIKey is RITCJGWRYRCYLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4S/c1-13(2)4-3-5-14-6-8-9(7-14)15-10(11)12-8/h3-7H2,1-2H3,(H2,11,12).
What are the key properties of 5-[3-(dimethylamino)propyl]-4,6-dihydropyrrolo[3,4-d][1,3]thiazol-2-amine?
5-[3-(dimethylamino)propyl]-4,6-dihydropyrrolo[3,4-d][1,3]thiazol-2-amine has a molecular weight of 226.35 g/mol, XLogP of 0.99, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[3-(dimethylamino)propyl]-4,6-dihydropyrrolo[3,4-d][1,3]thiazol-2-amine is sourced from PubChem (CID 82194316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).