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

C11H18N2OS — CID 19029670

IUPACN-(5-propyl-1,3-thiazol-2-yl)pentanamide
SMILESCCCCC(=O)Nc1ncc(CCC)s1
InChIInChI=1S/C11H18N2OS/c1-3-5-7-10(14)13-11-12-8-9(15-11)6-4-2/h8H,3-7H2,1-2H3,(H,12,13,14)
InChIKeyCNGJMXVIWYNNEV-UHFFFAOYSA-N
MW226.34 g/mol
LogP3.22
Rot. Bonds6

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

N-(5-propyl-1,3-thiazol-2-yl)pentanamide (PubChem CID 19029670) has the molecular formula C11H18N2OS and a molecular weight of 226.34 g/mol. Its IUPAC name is N-(5-propyl-1,3-thiazol-2-yl)pentanamide.

Molecular Properties

Compound NameN-(5-propyl-1,3-thiazol-2-yl)pentanamide
PubChem CID19029670
Molecular FormulaC11H18N2OS
Molecular Weight226.34 g/mol
Exact Mass226.11
IUPAC NameN-(5-propyl-1,3-thiazol-2-yl)pentanamide
SMILESCCCCC(=O)Nc1ncc(CCC)s1
InChIInChI=1S/C11H18N2OS/c1-3-5-7-10(14)13-11-12-8-9(15-11)6-4-2/h8H,3-7H2,1-2H3,(H,12,13,14)
InChIKeyCNGJMXVIWYNNEV-UHFFFAOYSA-N
XLogP3.22
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.34
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(5-propyl-1,3-thiazol-2-yl)pentanamide?
The IUPAC name of N-(5-propyl-1,3-thiazol-2-yl)pentanamide (CID 19029670) is N-(5-propyl-1,3-thiazol-2-yl)pentanamide.
What is the SMILES notation for N-(5-propyl-1,3-thiazol-2-yl)pentanamide?
The canonical SMILES for N-(5-propyl-1,3-thiazol-2-yl)pentanamide is CCCCC(=O)Nc1ncc(CCC)s1.
What is the InChIKey of N-(5-propyl-1,3-thiazol-2-yl)pentanamide?
The InChIKey is CNGJMXVIWYNNEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2OS/c1-3-5-7-10(14)13-11-12-8-9(15-11)6-4-2/h8H,3-7H2,1-2H3,(H,12,13,14).
What are the key properties of N-(5-propyl-1,3-thiazol-2-yl)pentanamide?
N-(5-propyl-1,3-thiazol-2-yl)pentanamide has a molecular weight of 226.34 g/mol, XLogP of 3.22, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-propyl-1,3-thiazol-2-yl)pentanamide is sourced from PubChem (CID 19029670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).