N-butan-2-yl-N-butyl-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide

C14H24N2O2S — CID 78858380

IUPACN-butan-2-yl-N-butyl-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide
SMILESCCCCN(C(=O)Cn1c(C)csc1=O)C(C)CC
InChIInChI=1S/C14H24N2O2S/c1-5-7-8-15(11(3)6-2)13(17)9-16-12(4)10-19-14(16)18/h10-11H,5-9H2,1-4H3
InChIKeyQPTAJEJUWHXWKU-UHFFFAOYSA-N
MW284.42 g/mol
LogP2.65
Rot. Bonds7

About N-butan-2-yl-N-butyl-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide

N-butan-2-yl-N-butyl-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide (PubChem CID 78858380) has the molecular formula C14H24N2O2S and a molecular weight of 284.42 g/mol. Its IUPAC name is N-butan-2-yl-N-butyl-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide.

Molecular Properties

Compound NameN-butan-2-yl-N-butyl-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide
PubChem CID78858380
Molecular FormulaC14H24N2O2S
Molecular Weight284.42 g/mol
Exact Mass284.16
IUPAC NameN-butan-2-yl-N-butyl-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide
SMILESCCCCN(C(=O)Cn1c(C)csc1=O)C(C)CC
InChIInChI=1S/C14H24N2O2S/c1-5-7-8-15(11(3)6-2)13(17)9-16-12(4)10-19-14(16)18/h10-11H,5-9H2,1-4H3
InChIKeyQPTAJEJUWHXWKU-UHFFFAOYSA-N
XLogP2.65
TPSA42.31 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.42
LogP ≤ 52.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-butan-2-yl-N-butyl-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide?
The IUPAC name of N-butan-2-yl-N-butyl-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide (CID 78858380) is N-butan-2-yl-N-butyl-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide.
What is the SMILES notation for N-butan-2-yl-N-butyl-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide?
The canonical SMILES for N-butan-2-yl-N-butyl-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide is CCCCN(C(=O)Cn1c(C)csc1=O)C(C)CC.
What is the InChIKey of N-butan-2-yl-N-butyl-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide?
The InChIKey is QPTAJEJUWHXWKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O2S/c1-5-7-8-15(11(3)6-2)13(17)9-16-12(4)10-19-14(16)18/h10-11H,5-9H2,1-4H3.
What are the key properties of N-butan-2-yl-N-butyl-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide?
N-butan-2-yl-N-butyl-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide has a molecular weight of 284.42 g/mol, XLogP of 2.65, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-butan-2-yl-N-butyl-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide is sourced from PubChem (CID 78858380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).