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

C9H15N3OS — CID 119307130

IUPAC2-amino-N-(5-ethyl-1,3-thiazol-2-yl)-2-methylpropanamide
SMILESCCc1cnc(NC(=O)C(C)(C)N)s1
InChIInChI=1S/C9H15N3OS/c1-4-6-5-11-8(14-6)12-7(13)9(2,3)10/h5H,4,10H2,1-3H3,(H,11,12,13)
InChIKeyORLKPNCQLVBVHC-UHFFFAOYSA-N
MW213.31 g/mol
LogP1.38
Rot. Bonds3

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

2-amino-N-(5-ethyl-1,3-thiazol-2-yl)-2-methylpropanamide (PubChem CID 119307130) has the molecular formula C9H15N3OS and a molecular weight of 213.31 g/mol. Its IUPAC name is 2-amino-N-(5-ethyl-1,3-thiazol-2-yl)-2-methylpropanamide.

Molecular Properties

Compound Name2-amino-N-(5-ethyl-1,3-thiazol-2-yl)-2-methylpropanamide
PubChem CID119307130
Molecular FormulaC9H15N3OS
Molecular Weight213.31 g/mol
Exact Mass213.09
IUPAC Name2-amino-N-(5-ethyl-1,3-thiazol-2-yl)-2-methylpropanamide
SMILESCCc1cnc(NC(=O)C(C)(C)N)s1
InChIInChI=1S/C9H15N3OS/c1-4-6-5-11-8(14-6)12-7(13)9(2,3)10/h5H,4,10H2,1-3H3,(H,11,12,13)
InChIKeyORLKPNCQLVBVHC-UHFFFAOYSA-N
XLogP1.38
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.31
LogP ≤ 51.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(5-ethyl-1,3-thiazol-2-yl)-2-methylpropanamide?
The IUPAC name of 2-amino-N-(5-ethyl-1,3-thiazol-2-yl)-2-methylpropanamide (CID 119307130) is 2-amino-N-(5-ethyl-1,3-thiazol-2-yl)-2-methylpropanamide.
What is the SMILES notation for 2-amino-N-(5-ethyl-1,3-thiazol-2-yl)-2-methylpropanamide?
The canonical SMILES for 2-amino-N-(5-ethyl-1,3-thiazol-2-yl)-2-methylpropanamide is CCc1cnc(NC(=O)C(C)(C)N)s1.
What is the InChIKey of 2-amino-N-(5-ethyl-1,3-thiazol-2-yl)-2-methylpropanamide?
The InChIKey is ORLKPNCQLVBVHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3OS/c1-4-6-5-11-8(14-6)12-7(13)9(2,3)10/h5H,4,10H2,1-3H3,(H,11,12,13).
What are the key properties of 2-amino-N-(5-ethyl-1,3-thiazol-2-yl)-2-methylpropanamide?
2-amino-N-(5-ethyl-1,3-thiazol-2-yl)-2-methylpropanamide has a molecular weight of 213.31 g/mol, XLogP of 1.38, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(5-ethyl-1,3-thiazol-2-yl)-2-methylpropanamide is sourced from PubChem (CID 119307130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).