2-[(5-amino-1,3-thiazol-2-yl)amino]-N-ethyl-N-methylpropanamide

C9H16N4OS — CID 103106716

IUPAC2-[(5-amino-1,3-thiazol-2-yl)amino]-N-ethyl-N-methylpropanamide
SMILESCCN(C)C(=O)C(C)Nc1ncc(N)s1
InChIInChI=1S/C9H16N4OS/c1-4-13(3)8(14)6(2)12-9-11-5-7(10)15-9/h5-6H,4,10H2,1-3H3,(H,11,12)
InChIKeyWHLACHJVWJARKF-UHFFFAOYSA-N
MW228.32 g/mol
LogP1.00
Rot. Bonds4

About 2-[(5-amino-1,3-thiazol-2-yl)amino]-N-ethyl-N-methylpropanamide

2-[(5-amino-1,3-thiazol-2-yl)amino]-N-ethyl-N-methylpropanamide (PubChem CID 103106716) has the molecular formula C9H16N4OS and a molecular weight of 228.32 g/mol. Its IUPAC name is 2-[(5-amino-1,3-thiazol-2-yl)amino]-N-ethyl-N-methylpropanamide.

Molecular Properties

Compound Name2-[(5-amino-1,3-thiazol-2-yl)amino]-N-ethyl-N-methylpropanamide
PubChem CID103106716
Molecular FormulaC9H16N4OS
Molecular Weight228.32 g/mol
Exact Mass228.10
IUPAC Name2-[(5-amino-1,3-thiazol-2-yl)amino]-N-ethyl-N-methylpropanamide
SMILESCCN(C)C(=O)C(C)Nc1ncc(N)s1
InChIInChI=1S/C9H16N4OS/c1-4-13(3)8(14)6(2)12-9-11-5-7(10)15-9/h5-6H,4,10H2,1-3H3,(H,11,12)
InChIKeyWHLACHJVWJARKF-UHFFFAOYSA-N
XLogP1.00
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.32
LogP ≤ 51.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-[(3-amino-1,2-thiazol-5-yl)amino]-N-ethyl-N-methylpropanamide
CID 103365954
2-[(5-amino-1,3-thiazol-2-yl)amino]propan-1-ol
CID 102767605
2-[(3-amino-5-chloro-2-pyridinyl)amino]-N-ethyl-N-methylpropanamide
CID 103106676
2-[(5-amino-1,3-thiazol-2-yl)amino]-3-methylbutanamide
CID 106344040
5-amino-6-[[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]amino]pyridine-3-carboxylic acid
CID 103113348
2-N-(3-ethylpentan-2-yl)-1,3-thiazole-2,5-diamine
CID 102768492
2-[(6-bromo-1,3-benzothiazol-2-yl)amino]-N-ethyl-N-methylpropanamide
CID 103112246
2-[(4-amino-1,3-benzothiazol-5-yl)amino]-N-ethyl-N-methylpropanamide
CID 103106749
N-ethyl-2-[(6-hydrazinylpyrimidin-4-yl)amino]-N-methylpropanamide
CID 103114097
2-[(3-amino-4-methyl-1,2-thiazol-5-yl)amino]-N-ethyl-N-methylpropanamide
CID 103365951
2-[[5-(dimethylsulfamoyl)-2-pyridinyl]amino]-N-ethyl-N-methylpropanamide
CID 103270036
2-[[6-amino-2-(trifluoromethyl)pyrimidin-4-yl]amino]-N-ethyl-N-methylpropanamide
CID 106773392

Frequently Asked Questions

What is the IUPAC name of 2-[(5-amino-1,3-thiazol-2-yl)amino]-N-ethyl-N-methylpropanamide?
The IUPAC name of 2-[(5-amino-1,3-thiazol-2-yl)amino]-N-ethyl-N-methylpropanamide (CID 103106716) is 2-[(5-amino-1,3-thiazol-2-yl)amino]-N-ethyl-N-methylpropanamide.
What is the SMILES notation for 2-[(5-amino-1,3-thiazol-2-yl)amino]-N-ethyl-N-methylpropanamide?
The canonical SMILES for 2-[(5-amino-1,3-thiazol-2-yl)amino]-N-ethyl-N-methylpropanamide is CCN(C)C(=O)C(C)Nc1ncc(N)s1.
What is the InChIKey of 2-[(5-amino-1,3-thiazol-2-yl)amino]-N-ethyl-N-methylpropanamide?
The InChIKey is WHLACHJVWJARKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N4OS/c1-4-13(3)8(14)6(2)12-9-11-5-7(10)15-9/h5-6H,4,10H2,1-3H3,(H,11,12).
What are the key properties of 2-[(5-amino-1,3-thiazol-2-yl)amino]-N-ethyl-N-methylpropanamide?
2-[(5-amino-1,3-thiazol-2-yl)amino]-N-ethyl-N-methylpropanamide has a molecular weight of 228.32 g/mol, XLogP of 1.00, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-amino-1,3-thiazol-2-yl)amino]-N-ethyl-N-methylpropanamide is sourced from PubChem (CID 103106716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).