2-[2-(dimethylamino)ethylamino]-N-(5-methyl-1,3-thiazol-2-yl)propanamide

C11H20N4OS — CID 3229632

IUPAC2-[2-(dimethylamino)ethylamino]-N-(5-methyl-1,3-thiazol-2-yl)propanamide
SMILESCc1cnc(NC(=O)C(C)NCCN(C)C)s1
InChIInChI=1S/C11H20N4OS/c1-8-7-13-11(17-8)14-10(16)9(2)12-5-6-15(3)4/h7,9,12H,5-6H2,1-4H3,(H,13,14,16)
InChIKeySSIODKZXOTVKMT-UHFFFAOYSA-N
MW256.37 g/mol
LogP0.93
Rot. Bonds6

About 2-[2-(dimethylamino)ethylamino]-N-(5-methyl-1,3-thiazol-2-yl)propanamide

2-[2-(dimethylamino)ethylamino]-N-(5-methyl-1,3-thiazol-2-yl)propanamide (PubChem CID 3229632) has the molecular formula C11H20N4OS and a molecular weight of 256.37 g/mol. Its IUPAC name is 2-[2-(dimethylamino)ethylamino]-N-(5-methyl-1,3-thiazol-2-yl)propanamide.

Molecular Properties

Compound Name2-[2-(dimethylamino)ethylamino]-N-(5-methyl-1,3-thiazol-2-yl)propanamide
PubChem CID3229632
Molecular FormulaC11H20N4OS
Molecular Weight256.37 g/mol
Exact Mass256.14
IUPAC Name2-[2-(dimethylamino)ethylamino]-N-(5-methyl-1,3-thiazol-2-yl)propanamide
SMILESCc1cnc(NC(=O)C(C)NCCN(C)C)s1
InChIInChI=1S/C11H20N4OS/c1-8-7-13-11(17-8)14-10(16)9(2)12-5-6-15(3)4/h7,9,12H,5-6H2,1-4H3,(H,13,14,16)
InChIKeySSIODKZXOTVKMT-UHFFFAOYSA-N
XLogP0.93
TPSA57.26 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.37
LogP ≤ 50.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-[2-(dimethylamino)ethylamino]-N-(5-methyl-1,3-thiazol-2-yl)propanamide 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-[2-(dimethylamino)ethylamino]-N-(5-methyl-1,3-thiazol-2-yl)propanamide?
The IUPAC name of 2-[2-(dimethylamino)ethylamino]-N-(5-methyl-1,3-thiazol-2-yl)propanamide (CID 3229632) is 2-[2-(dimethylamino)ethylamino]-N-(5-methyl-1,3-thiazol-2-yl)propanamide.
What is the SMILES notation for 2-[2-(dimethylamino)ethylamino]-N-(5-methyl-1,3-thiazol-2-yl)propanamide?
The canonical SMILES for 2-[2-(dimethylamino)ethylamino]-N-(5-methyl-1,3-thiazol-2-yl)propanamide is Cc1cnc(NC(=O)C(C)NCCN(C)C)s1.
What is the InChIKey of 2-[2-(dimethylamino)ethylamino]-N-(5-methyl-1,3-thiazol-2-yl)propanamide?
The InChIKey is SSIODKZXOTVKMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4OS/c1-8-7-13-11(17-8)14-10(16)9(2)12-5-6-15(3)4/h7,9,12H,5-6H2,1-4H3,(H,13,14,16).
What are the key properties of 2-[2-(dimethylamino)ethylamino]-N-(5-methyl-1,3-thiazol-2-yl)propanamide?
2-[2-(dimethylamino)ethylamino]-N-(5-methyl-1,3-thiazol-2-yl)propanamide has a molecular weight of 256.37 g/mol, XLogP of 0.93, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(dimethylamino)ethylamino]-N-(5-methyl-1,3-thiazol-2-yl)propanamide is sourced from PubChem (CID 3229632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).