2-[(3-amino-4-pyridin-4-yl-1,2-thiazol-5-yl)amino]-N,N-dimethylpropanamide

C13H17N5OS — CID 103359608

IUPAC2-[(3-amino-4-pyridin-4-yl-1,2-thiazol-5-yl)amino]-N,N-dimethylpropanamide
SMILESCC(Nc1snc(N)c1-c1ccncc1)C(=O)N(C)C
InChIInChI=1S/C13H17N5OS/c1-8(13(19)18(2)3)16-12-10(11(14)17-20-12)9-4-6-15-7-5-9/h4-8,16H,1-3H3,(H2,14,17)
InChIKeyJZVBQDPJEJGJGZ-UHFFFAOYSA-N
MW291.38 g/mol
LogP1.68
Rot. Bonds4

About 2-[(3-amino-4-pyridin-4-yl-1,2-thiazol-5-yl)amino]-N,N-dimethylpropanamide

2-[(3-amino-4-pyridin-4-yl-1,2-thiazol-5-yl)amino]-N,N-dimethylpropanamide (PubChem CID 103359608) has the molecular formula C13H17N5OS and a molecular weight of 291.38 g/mol. Its IUPAC name is 2-[(3-amino-4-pyridin-4-yl-1,2-thiazol-5-yl)amino]-N,N-dimethylpropanamide.

Molecular Properties

Compound Name2-[(3-amino-4-pyridin-4-yl-1,2-thiazol-5-yl)amino]-N,N-dimethylpropanamide
PubChem CID103359608
Molecular FormulaC13H17N5OS
Molecular Weight291.38 g/mol
Exact Mass291.12
IUPAC Name2-[(3-amino-4-pyridin-4-yl-1,2-thiazol-5-yl)amino]-N,N-dimethylpropanamide
SMILESCC(Nc1snc(N)c1-c1ccncc1)C(=O)N(C)C
InChIInChI=1S/C13H17N5OS/c1-8(13(19)18(2)3)16-12-10(11(14)17-20-12)9-4-6-15-7-5-9/h4-8,16H,1-3H3,(H2,14,17)
InChIKeyJZVBQDPJEJGJGZ-UHFFFAOYSA-N
XLogP1.68
TPSA84.14 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.38
LogP ≤ 51.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Launch Full Analysis

Related Compounds

4-pyridin-4-yl-5-N-(1-pyridin-4-ylethyl)-1,2-thiazole-3,5-diamine
CID 103363995
5-N-[1-(dimethylamino)-3-methylbutan-2-yl]-4-pyridin-4-yl-1,2-thiazole-3,5-diamine
CID 103360020
5-N-(3-methylpentan-2-yl)-4-pyridin-4-yl-1,2-thiazole-3,5-diamine
CID 103359578
5-N-(1-ethoxypropan-2-yl)-4-pyridin-4-yl-1,2-thiazole-3,5-diamine
CID 103360282
4-[(3-amino-4-pyridin-4-yl-1,2-thiazol-5-yl)amino]butan-2-ol
CID 103359777
4-pyridin-4-yl-5-N-(2,3,3-trimethylbutyl)-1,2-thiazole-3,5-diamine
CID 103365005
2-[(3-amino-4-pyridin-4-yl-1,2-thiazol-5-yl)-methylamino]-N-ethylacetamide
CID 103361438
2-[(3-amino-4-methyl-1,2-thiazol-5-yl)amino]-N-ethyl-N-methylpropanamide
CID 103365951
5-N-[4-(dimethylamino)butan-2-yl]-4-pyridin-3-yl-1,2-thiazole-3,5-diamine
CID 103360134
3-[(3-amino-4-pyridin-4-yl-1,2-thiazol-5-yl)amino]-2,2-difluoropropan-1-ol
CID 106174702
4-(2-methyl-1,3-thiazol-4-yl)-5-N-(1-pyridin-4-ylethyl)-1,2-thiazole-3,5-diamine
CID 103382912
2-[2-[(3-amino-4-pyridin-4-yl-1,2-thiazol-5-yl)amino]ethoxy]ethanol
CID 103360990

Frequently Asked Questions

What is the IUPAC name of 2-[(3-amino-4-pyridin-4-yl-1,2-thiazol-5-yl)amino]-N,N-dimethylpropanamide?
The IUPAC name of 2-[(3-amino-4-pyridin-4-yl-1,2-thiazol-5-yl)amino]-N,N-dimethylpropanamide (CID 103359608) is 2-[(3-amino-4-pyridin-4-yl-1,2-thiazol-5-yl)amino]-N,N-dimethylpropanamide.
What is the SMILES notation for 2-[(3-amino-4-pyridin-4-yl-1,2-thiazol-5-yl)amino]-N,N-dimethylpropanamide?
The canonical SMILES for 2-[(3-amino-4-pyridin-4-yl-1,2-thiazol-5-yl)amino]-N,N-dimethylpropanamide is CC(Nc1snc(N)c1-c1ccncc1)C(=O)N(C)C.
What is the InChIKey of 2-[(3-amino-4-pyridin-4-yl-1,2-thiazol-5-yl)amino]-N,N-dimethylpropanamide?
The InChIKey is JZVBQDPJEJGJGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N5OS/c1-8(13(19)18(2)3)16-12-10(11(14)17-20-12)9-4-6-15-7-5-9/h4-8,16H,1-3H3,(H2,14,17).
What are the key properties of 2-[(3-amino-4-pyridin-4-yl-1,2-thiazol-5-yl)amino]-N,N-dimethylpropanamide?
2-[(3-amino-4-pyridin-4-yl-1,2-thiazol-5-yl)amino]-N,N-dimethylpropanamide has a molecular weight of 291.38 g/mol, XLogP of 1.68, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-amino-4-pyridin-4-yl-1,2-thiazol-5-yl)amino]-N,N-dimethylpropanamide is sourced from PubChem (CID 103359608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).