2-[[2-(dimethylamino)-4-methoxy-1,3-thiazol-5-yl]methylamino]-N-methylacetamide

C10H18N4O2S — CID 43665236

IUPAC2-[[2-(dimethylamino)-4-methoxy-1,3-thiazol-5-yl]methylamino]-N-methylacetamide
SMILESCNC(=O)CNCc1sc(N(C)C)nc1OC
InChIInChI=1S/C10H18N4O2S/c1-11-8(15)6-12-5-7-9(16-4)13-10(17-7)14(2)3/h12H,5-6H2,1-4H3,(H,11,15)
InChIKeyTZFMSRYMHJMMDG-UHFFFAOYSA-N
MW258.35 g/mol
LogP0.05
Rot. Bonds6

About 2-[[2-(dimethylamino)-4-methoxy-1,3-thiazol-5-yl]methylamino]-N-methylacetamide

2-[[2-(dimethylamino)-4-methoxy-1,3-thiazol-5-yl]methylamino]-N-methylacetamide (PubChem CID 43665236) has the molecular formula C10H18N4O2S and a molecular weight of 258.35 g/mol. Its IUPAC name is 2-[[2-(dimethylamino)-4-methoxy-1,3-thiazol-5-yl]methylamino]-N-methylacetamide.

Molecular Properties

Compound Name2-[[2-(dimethylamino)-4-methoxy-1,3-thiazol-5-yl]methylamino]-N-methylacetamide
PubChem CID43665236
Molecular FormulaC10H18N4O2S
Molecular Weight258.35 g/mol
Exact Mass258.12
IUPAC Name2-[[2-(dimethylamino)-4-methoxy-1,3-thiazol-5-yl]methylamino]-N-methylacetamide
SMILESCNC(=O)CNCc1sc(N(C)C)nc1OC
InChIInChI=1S/C10H18N4O2S/c1-11-8(15)6-12-5-7-9(16-4)13-10(17-7)14(2)3/h12H,5-6H2,1-4H3,(H,11,15)
InChIKeyTZFMSRYMHJMMDG-UHFFFAOYSA-N
XLogP0.05
TPSA66.49 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.35
LogP ≤ 50.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 2-[[2-(dimethylamino)-4-methoxy-1,3-thiazol-5-yl]methylamino]-N-methylacetamide 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)-4-methoxy-1,3-thiazol-5-yl]methylamino]-N-methylacetamide?
The IUPAC name of 2-[[2-(dimethylamino)-4-methoxy-1,3-thiazol-5-yl]methylamino]-N-methylacetamide (CID 43665236) is 2-[[2-(dimethylamino)-4-methoxy-1,3-thiazol-5-yl]methylamino]-N-methylacetamide.
What is the SMILES notation for 2-[[2-(dimethylamino)-4-methoxy-1,3-thiazol-5-yl]methylamino]-N-methylacetamide?
The canonical SMILES for 2-[[2-(dimethylamino)-4-methoxy-1,3-thiazol-5-yl]methylamino]-N-methylacetamide is CNC(=O)CNCc1sc(N(C)C)nc1OC.
What is the InChIKey of 2-[[2-(dimethylamino)-4-methoxy-1,3-thiazol-5-yl]methylamino]-N-methylacetamide?
The InChIKey is TZFMSRYMHJMMDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O2S/c1-11-8(15)6-12-5-7-9(16-4)13-10(17-7)14(2)3/h12H,5-6H2,1-4H3,(H,11,15).
What are the key properties of 2-[[2-(dimethylamino)-4-methoxy-1,3-thiazol-5-yl]methylamino]-N-methylacetamide?
2-[[2-(dimethylamino)-4-methoxy-1,3-thiazol-5-yl]methylamino]-N-methylacetamide has a molecular weight of 258.35 g/mol, XLogP of 0.05, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(dimethylamino)-4-methoxy-1,3-thiazol-5-yl]methylamino]-N-methylacetamide is sourced from PubChem (CID 43665236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).