2-[(3-amino-4-methyl-1,2-thiazol-5-yl)amino]-N-ethyl-N-methylpropanamide

C10H18N4OS — CID 103365951

IUPAC2-[(3-amino-4-methyl-1,2-thiazol-5-yl)amino]-N-ethyl-N-methylpropanamide
SMILESCCN(C)C(=O)C(C)Nc1snc(N)c1C
InChIInChI=1S/C10H18N4OS/c1-5-14(4)10(15)7(3)12-9-6(2)8(11)13-16-9/h7,12H,5H2,1-4H3,(H2,11,13)
InChIKeyZHHNILGOPUWSEF-UHFFFAOYSA-N
MW242.35 g/mol
LogP1.31
Rot. Bonds4

About 2-[(3-amino-4-methyl-1,2-thiazol-5-yl)amino]-N-ethyl-N-methylpropanamide

2-[(3-amino-4-methyl-1,2-thiazol-5-yl)amino]-N-ethyl-N-methylpropanamide (PubChem CID 103365951) has the molecular formula C10H18N4OS and a molecular weight of 242.35 g/mol. Its IUPAC name is 2-[(3-amino-4-methyl-1,2-thiazol-5-yl)amino]-N-ethyl-N-methylpropanamide.

Molecular Properties

Compound Name2-[(3-amino-4-methyl-1,2-thiazol-5-yl)amino]-N-ethyl-N-methylpropanamide
PubChem CID103365951
Molecular FormulaC10H18N4OS
Molecular Weight242.35 g/mol
Exact Mass242.12
IUPAC Name2-[(3-amino-4-methyl-1,2-thiazol-5-yl)amino]-N-ethyl-N-methylpropanamide
SMILESCCN(C)C(=O)C(C)Nc1snc(N)c1C
InChIInChI=1S/C10H18N4OS/c1-5-14(4)10(15)7(3)12-9-6(2)8(11)13-16-9/h7,12H,5H2,1-4H3,(H2,11,13)
InChIKeyZHHNILGOPUWSEF-UHFFFAOYSA-N
XLogP1.31
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.35
LogP ≤ 51.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

ethyl 3-amino-5-[[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]amino]-1,2-thiazole-4-carboxylate
CID 103384816
3-amino-5-[[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]amino]-N-propan-2-yl-1,2-thiazole-4-carboxamide
CID 103384824
2-[(3-amino-1,2-thiazol-5-yl)amino]-N-ethyl-N-methylpropanamide
CID 103365954
3-amino-5-[[1-(diethylamino)-1-oxopropan-2-yl]amino]-N-methyl-1,2-thiazole-4-carboxamide
CID 103383996
5-N-[1-(dimethylamino)propan-2-yl]-4-methyl-1,2-thiazole-3,5-diamine
CID 103364802
5-N-[4-(dimethylamino)butan-2-yl]-4-methyl-1,2-thiazole-3,5-diamine
CID 103360138
2-[(5-amino-1,3-thiazol-2-yl)amino]-N-ethyl-N-methylpropanamide
CID 103106716
2-[(4-amino-3-methyl-1-propylpyrazol-5-yl)amino]-N-ethyl-N-methylpropanamide
CID 103106758
2-[(4-amino-1,3-benzothiazol-5-yl)amino]-N-ethyl-N-methylpropanamide
CID 103106749
2-[(4-carbamothioyl-5,6-dimethylpyridazin-3-yl)amino]-N-ethyl-N-methylpropanamide
CID 103110463
2-[(3-amino-4-pyridin-4-yl-1,2-thiazol-5-yl)amino]-N,N-dimethylpropanamide
CID 103359608
2-[(4-amino-3-ethyl-1-methylpyrazol-5-yl)amino]-N-ethyl-N-methylpropanamide
CID 103106733

Frequently Asked Questions

What is the IUPAC name of 2-[(3-amino-4-methyl-1,2-thiazol-5-yl)amino]-N-ethyl-N-methylpropanamide?
The IUPAC name of 2-[(3-amino-4-methyl-1,2-thiazol-5-yl)amino]-N-ethyl-N-methylpropanamide (CID 103365951) is 2-[(3-amino-4-methyl-1,2-thiazol-5-yl)amino]-N-ethyl-N-methylpropanamide.
What is the SMILES notation for 2-[(3-amino-4-methyl-1,2-thiazol-5-yl)amino]-N-ethyl-N-methylpropanamide?
The canonical SMILES for 2-[(3-amino-4-methyl-1,2-thiazol-5-yl)amino]-N-ethyl-N-methylpropanamide is CCN(C)C(=O)C(C)Nc1snc(N)c1C.
What is the InChIKey of 2-[(3-amino-4-methyl-1,2-thiazol-5-yl)amino]-N-ethyl-N-methylpropanamide?
The InChIKey is ZHHNILGOPUWSEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4OS/c1-5-14(4)10(15)7(3)12-9-6(2)8(11)13-16-9/h7,12H,5H2,1-4H3,(H2,11,13).
What are the key properties of 2-[(3-amino-4-methyl-1,2-thiazol-5-yl)amino]-N-ethyl-N-methylpropanamide?
2-[(3-amino-4-methyl-1,2-thiazol-5-yl)amino]-N-ethyl-N-methylpropanamide has a molecular weight of 242.35 g/mol, XLogP of 1.31, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-amino-4-methyl-1,2-thiazol-5-yl)amino]-N-ethyl-N-methylpropanamide is sourced from PubChem (CID 103365951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).