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

C8H12N2OS — CID 19029689

IUPACN-(5-ethyl-1,3-thiazol-2-yl)propanamide
SMILESCCC(=O)Nc1ncc(CC)s1
InChIInChI=1S/C8H12N2OS/c1-3-6-5-9-8(12-6)10-7(11)4-2/h5H,3-4H2,1-2H3,(H,9,10,11)
InChIKeyFRVSFMLFUSTWPH-UHFFFAOYSA-N
MW184.26 g/mol
LogP2.05
Rot. Bonds3

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

N-(5-ethyl-1,3-thiazol-2-yl)propanamide (PubChem CID 19029689) has the molecular formula C8H12N2OS and a molecular weight of 184.26 g/mol. Its IUPAC name is N-(5-ethyl-1,3-thiazol-2-yl)propanamide.

Molecular Properties

Compound NameN-(5-ethyl-1,3-thiazol-2-yl)propanamide
PubChem CID19029689
Molecular FormulaC8H12N2OS
Molecular Weight184.26 g/mol
Exact Mass184.07
IUPAC NameN-(5-ethyl-1,3-thiazol-2-yl)propanamide
SMILESCCC(=O)Nc1ncc(CC)s1
InChIInChI=1S/C8H12N2OS/c1-3-6-5-9-8(12-6)10-7(11)4-2/h5H,3-4H2,1-2H3,(H,9,10,11)
InChIKeyFRVSFMLFUSTWPH-UHFFFAOYSA-N
XLogP2.05
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.26
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(5-ethyl-1,3-thiazol-2-yl)propanamide?
The IUPAC name of N-(5-ethyl-1,3-thiazol-2-yl)propanamide (CID 19029689) is N-(5-ethyl-1,3-thiazol-2-yl)propanamide.
What is the SMILES notation for N-(5-ethyl-1,3-thiazol-2-yl)propanamide?
The canonical SMILES for N-(5-ethyl-1,3-thiazol-2-yl)propanamide is CCC(=O)Nc1ncc(CC)s1.
What is the InChIKey of N-(5-ethyl-1,3-thiazol-2-yl)propanamide?
The InChIKey is FRVSFMLFUSTWPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2OS/c1-3-6-5-9-8(12-6)10-7(11)4-2/h5H,3-4H2,1-2H3,(H,9,10,11).
What are the key properties of N-(5-ethyl-1,3-thiazol-2-yl)propanamide?
N-(5-ethyl-1,3-thiazol-2-yl)propanamide has a molecular weight of 184.26 g/mol, XLogP of 2.05, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-ethyl-1,3-thiazol-2-yl)propanamide is sourced from PubChem (CID 19029689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).