N-(4,5-dimethyl-1,3-thiazol-2-yl)nonanamide

C14H24N2OS — CID 4070325

IUPACN-(4,5-dimethyl-1,3-thiazol-2-yl)nonanamide
SMILESCCCCCCCCC(=O)Nc1nc(C)c(C)s1
InChIInChI=1S/C14H24N2OS/c1-4-5-6-7-8-9-10-13(17)16-14-15-11(2)12(3)18-14/h4-10H2,1-3H3,(H,15,16,17)
InChIKeyUZQZHPKUCQYPMH-UHFFFAOYSA-N
MW268.43 g/mol
LogP4.45
Rot. Bonds8

About N-(4,5-dimethyl-1,3-thiazol-2-yl)nonanamide

N-(4,5-dimethyl-1,3-thiazol-2-yl)nonanamide (PubChem CID 4070325) has the molecular formula C14H24N2OS and a molecular weight of 268.43 g/mol. Its IUPAC name is N-(4,5-dimethyl-1,3-thiazol-2-yl)nonanamide.

Molecular Properties

Compound NameN-(4,5-dimethyl-1,3-thiazol-2-yl)nonanamide
PubChem CID4070325
Molecular FormulaC14H24N2OS
Molecular Weight268.43 g/mol
Exact Mass268.16
IUPAC NameN-(4,5-dimethyl-1,3-thiazol-2-yl)nonanamide
SMILESCCCCCCCCC(=O)Nc1nc(C)c(C)s1
InChIInChI=1S/C14H24N2OS/c1-4-5-6-7-8-9-10-13(17)16-14-15-11(2)12(3)18-14/h4-10H2,1-3H3,(H,15,16,17)
InChIKeyUZQZHPKUCQYPMH-UHFFFAOYSA-N
XLogP4.45
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.43
LogP ≤ 54.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(4,5-dimethyl-1,3-thiazol-2-yl)nonanamide?
The IUPAC name of N-(4,5-dimethyl-1,3-thiazol-2-yl)nonanamide (CID 4070325) is N-(4,5-dimethyl-1,3-thiazol-2-yl)nonanamide.
What is the SMILES notation for N-(4,5-dimethyl-1,3-thiazol-2-yl)nonanamide?
The canonical SMILES for N-(4,5-dimethyl-1,3-thiazol-2-yl)nonanamide is CCCCCCCCC(=O)Nc1nc(C)c(C)s1.
What is the InChIKey of N-(4,5-dimethyl-1,3-thiazol-2-yl)nonanamide?
The InChIKey is UZQZHPKUCQYPMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2OS/c1-4-5-6-7-8-9-10-13(17)16-14-15-11(2)12(3)18-14/h4-10H2,1-3H3,(H,15,16,17).
What are the key properties of N-(4,5-dimethyl-1,3-thiazol-2-yl)nonanamide?
N-(4,5-dimethyl-1,3-thiazol-2-yl)nonanamide has a molecular weight of 268.43 g/mol, XLogP of 4.45, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4,5-dimethyl-1,3-thiazol-2-yl)nonanamide is sourced from PubChem (CID 4070325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).