N-(5-methyl-1,3-thiazol-2-yl)pentanamide

C9H14N2OS — CID 17190931

IUPACN-(5-methyl-1,3-thiazol-2-yl)pentanamide
SMILESCCCCC(=O)Nc1ncc(C)s1
InChIInChI=1S/C9H14N2OS/c1-3-4-5-8(12)11-9-10-6-7(2)13-9/h6H,3-5H2,1-2H3,(H,10,11,12)
InChIKeyRTKYLOJHLQVWJQ-UHFFFAOYSA-N
MW198.29 g/mol
LogP2.58
Rot. Bonds4

About N-(5-methyl-1,3-thiazol-2-yl)pentanamide

N-(5-methyl-1,3-thiazol-2-yl)pentanamide (PubChem CID 17190931) has the molecular formula C9H14N2OS and a molecular weight of 198.29 g/mol. Its IUPAC name is N-(5-methyl-1,3-thiazol-2-yl)pentanamide.

Molecular Properties

Compound NameN-(5-methyl-1,3-thiazol-2-yl)pentanamide
PubChem CID17190931
Molecular FormulaC9H14N2OS
Molecular Weight198.29 g/mol
Exact Mass198.08
IUPAC NameN-(5-methyl-1,3-thiazol-2-yl)pentanamide
SMILESCCCCC(=O)Nc1ncc(C)s1
InChIInChI=1S/C9H14N2OS/c1-3-4-5-8(12)11-9-10-6-7(2)13-9/h6H,3-5H2,1-2H3,(H,10,11,12)
InChIKeyRTKYLOJHLQVWJQ-UHFFFAOYSA-N
XLogP2.58
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.29
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(5-methyl-1,3-thiazol-2-yl)pentanamide?
The IUPAC name of N-(5-methyl-1,3-thiazol-2-yl)pentanamide (CID 17190931) is N-(5-methyl-1,3-thiazol-2-yl)pentanamide.
What is the SMILES notation for N-(5-methyl-1,3-thiazol-2-yl)pentanamide?
The canonical SMILES for N-(5-methyl-1,3-thiazol-2-yl)pentanamide is CCCCC(=O)Nc1ncc(C)s1.
What is the InChIKey of N-(5-methyl-1,3-thiazol-2-yl)pentanamide?
The InChIKey is RTKYLOJHLQVWJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2OS/c1-3-4-5-8(12)11-9-10-6-7(2)13-9/h6H,3-5H2,1-2H3,(H,10,11,12).
What are the key properties of N-(5-methyl-1,3-thiazol-2-yl)pentanamide?
N-(5-methyl-1,3-thiazol-2-yl)pentanamide has a molecular weight of 198.29 g/mol, XLogP of 2.58, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methyl-1,3-thiazol-2-yl)pentanamide is sourced from PubChem (CID 17190931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).