2-[2-(4,5-dimethyl-1,3-thiazol-2-yl)propan-2-ylamino]-N-(4-methyl-1,3-thiazol-2-yl)acetamide

C14H20N4OS2 — CID 71986429

IUPAC2-[2-(4,5-dimethyl-1,3-thiazol-2-yl)propan-2-ylamino]-N-(4-methyl-1,3-thiazol-2-yl)acetamide
SMILESCc1csc(NC(=O)CNC(C)(C)c2nc(C)c(C)s2)n1
InChIInChI=1S/C14H20N4OS2/c1-8-7-20-13(16-8)18-11(19)6-15-14(4,5)12-17-9(2)10(3)21-12/h7,15H,6H2,1-5H3,(H,16,18,19)
InChIKeyRUSKRMPNOHWESM-UHFFFAOYSA-N
MW324.48 g/mol
LogP2.99
Rot. Bonds5

About 2-[2-(4,5-dimethyl-1,3-thiazol-2-yl)propan-2-ylamino]-N-(4-methyl-1,3-thiazol-2-yl)acetamide

2-[2-(4,5-dimethyl-1,3-thiazol-2-yl)propan-2-ylamino]-N-(4-methyl-1,3-thiazol-2-yl)acetamide (PubChem CID 71986429) has the molecular formula C14H20N4OS2 and a molecular weight of 324.48 g/mol. Its IUPAC name is 2-[2-(4,5-dimethyl-1,3-thiazol-2-yl)propan-2-ylamino]-N-(4-methyl-1,3-thiazol-2-yl)acetamide.

Molecular Properties

Compound Name2-[2-(4,5-dimethyl-1,3-thiazol-2-yl)propan-2-ylamino]-N-(4-methyl-1,3-thiazol-2-yl)acetamide
PubChem CID71986429
Molecular FormulaC14H20N4OS2
Molecular Weight324.48 g/mol
Exact Mass324.11
IUPAC Name2-[2-(4,5-dimethyl-1,3-thiazol-2-yl)propan-2-ylamino]-N-(4-methyl-1,3-thiazol-2-yl)acetamide
SMILESCc1csc(NC(=O)CNC(C)(C)c2nc(C)c(C)s2)n1
InChIInChI=1S/C14H20N4OS2/c1-8-7-20-13(16-8)18-11(19)6-15-14(4,5)12-17-9(2)10(3)21-12/h7,15H,6H2,1-5H3,(H,16,18,19)
InChIKeyRUSKRMPNOHWESM-UHFFFAOYSA-N
XLogP2.99
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.48
LogP ≤ 52.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 2-[2-(4,5-dimethyl-1,3-thiazol-2-yl)propan-2-ylamino]-N-(4-methyl-1,3-thiazol-2-yl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-methyl-2-[[2-[(4-methyl-1,3-thiazol-2-yl)amino]-2-oxoethyl]amino]pentanoic acid
CID 43619432
2-methyl-2-[2-[(4-methyl-1,3-thiazol-2-yl)amino]-2-oxoethyl]sulfanylpropanoic acid
CID 81223615
2-[tert-butyl-[2-[(4-methyl-1,3-thiazol-2-yl)amino]-2-oxoethyl]amino]acetic acid
CID 79269282
methyl N-[2-[(4-methyl-1,3-thiazol-2-yl)amino]-2-oxoethyl]carbamate
CID 47299980
(2R)-2-amino-3-methyl-3-[2-[(4-methyl-1,3-thiazol-2-yl)amino]-2-oxoethyl]sulfanylbutanoic acid
CID 106442737
2-(2-amino-2-methylpropyl)sulfanyl-N-(4-methyl-1,3-thiazol-2-yl)acetamide
CID 66224014
2-[ethyl-[2-[(4-methyl-1,3-thiazol-2-yl)amino]-2-oxoethyl]amino]-2-methylpropanoic acid
CID 55123515
3-amino-N-(4-methyl-1,3-thiazol-2-yl)-3-sulfanylidenepropanamide
CID 43120468
5-hydroxy-N-(4-methyl-1,3-thiazol-2-yl)pentanamide
CID 79198899
3-(2-methyl-1,3-thiazol-4-yl)-N-(4-methyl-1,3-thiazol-2-yl)propanamide
CID 110678667
1-tert-butyl-3-(4-methyl-1,3-thiazol-2-yl)urea;ethane
CID 143608747
3-[(4-methyl-1,3-thiazol-2-yl)carbamoylamino]butanoic acid
CID 61196654

Frequently Asked Questions

What is the IUPAC name of 2-[2-(4,5-dimethyl-1,3-thiazol-2-yl)propan-2-ylamino]-N-(4-methyl-1,3-thiazol-2-yl)acetamide?
The IUPAC name of 2-[2-(4,5-dimethyl-1,3-thiazol-2-yl)propan-2-ylamino]-N-(4-methyl-1,3-thiazol-2-yl)acetamide (CID 71986429) is 2-[2-(4,5-dimethyl-1,3-thiazol-2-yl)propan-2-ylamino]-N-(4-methyl-1,3-thiazol-2-yl)acetamide.
What is the SMILES notation for 2-[2-(4,5-dimethyl-1,3-thiazol-2-yl)propan-2-ylamino]-N-(4-methyl-1,3-thiazol-2-yl)acetamide?
The canonical SMILES for 2-[2-(4,5-dimethyl-1,3-thiazol-2-yl)propan-2-ylamino]-N-(4-methyl-1,3-thiazol-2-yl)acetamide is Cc1csc(NC(=O)CNC(C)(C)c2nc(C)c(C)s2)n1.
What is the InChIKey of 2-[2-(4,5-dimethyl-1,3-thiazol-2-yl)propan-2-ylamino]-N-(4-methyl-1,3-thiazol-2-yl)acetamide?
The InChIKey is RUSKRMPNOHWESM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4OS2/c1-8-7-20-13(16-8)18-11(19)6-15-14(4,5)12-17-9(2)10(3)21-12/h7,15H,6H2,1-5H3,(H,16,18,19).
What are the key properties of 2-[2-(4,5-dimethyl-1,3-thiazol-2-yl)propan-2-ylamino]-N-(4-methyl-1,3-thiazol-2-yl)acetamide?
2-[2-(4,5-dimethyl-1,3-thiazol-2-yl)propan-2-ylamino]-N-(4-methyl-1,3-thiazol-2-yl)acetamide has a molecular weight of 324.48 g/mol, XLogP of 2.99, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(4,5-dimethyl-1,3-thiazol-2-yl)propan-2-ylamino]-N-(4-methyl-1,3-thiazol-2-yl)acetamide is sourced from PubChem (CID 71986429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).