N-pentan-3-yl-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide

C15H19N3OS — CID 17434682

IUPACN-pentan-3-yl-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide
SMILESCCC(CC)NC(=O)Cc1csc(-c2ccccn2)n1
InChIInChI=1S/C15H19N3OS/c1-3-11(4-2)17-14(19)9-12-10-20-15(18-12)13-7-5-6-8-16-13/h5-8,10-11H,3-4,9H2,1-2H3,(H,17,19)
InChIKeyHTKYALGPUZSVRL-UHFFFAOYSA-N
MW289.40 g/mol
LogP3.05
Rot. Bonds6

About N-pentan-3-yl-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide

N-pentan-3-yl-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide (PubChem CID 17434682) has the molecular formula C15H19N3OS and a molecular weight of 289.40 g/mol. Its IUPAC name is N-pentan-3-yl-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide.

Molecular Properties

Compound NameN-pentan-3-yl-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide
PubChem CID17434682
Molecular FormulaC15H19N3OS
Molecular Weight289.40 g/mol
Exact Mass289.12
IUPAC NameN-pentan-3-yl-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide
SMILESCCC(CC)NC(=O)Cc1csc(-c2ccccn2)n1
InChIInChI=1S/C15H19N3OS/c1-3-11(4-2)17-14(19)9-12-10-20-15(18-12)13-7-5-6-8-16-13/h5-8,10-11H,3-4,9H2,1-2H3,(H,17,19)
InChIKeyHTKYALGPUZSVRL-UHFFFAOYSA-N
XLogP3.05
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.40
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-propan-2-yl-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide
CID 27648148
(2R)-3-methyl-2-[[2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetyl]amino]butanoic acid
CID 39165191
N-(1-hydroxy-3-methylbutan-2-yl)-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide
CID 91822699
N-[1-(3-chlorophenyl)propyl]-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide
CID 55582407
2-(2-pyridin-2-yl-1,3-thiazol-4-yl)-N-(1,1,1-trifluoro-3-methylbutan-2-yl)acetamide
CID 126827360
(2S)-2-[[2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetyl]amino]hexanoic acid
CID 39165215
N-[2-(ethylamino)ethyl]-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide;dihydrochloride
CID 119506122
N-(2-amino-2-ethylbutyl)-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide;dihydrochloride
CID 119641011
N-cyclooctyl-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide
CID 17449429
2-(2-pyridin-2-yl-1,3-thiazol-4-yl)-N-[(1S)-1-[3-(trifluoromethyl)phenyl]ethyl]acetamide
CID 26193084
N-[(4-chlorophenyl)methyl]-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide
CID 17434882
N-(3-ethoxypropyl)-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide
CID 32979634

Frequently Asked Questions

What is the IUPAC name of N-pentan-3-yl-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide?
The IUPAC name of N-pentan-3-yl-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide (CID 17434682) is N-pentan-3-yl-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide.
What is the SMILES notation for N-pentan-3-yl-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide?
The canonical SMILES for N-pentan-3-yl-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide is CCC(CC)NC(=O)Cc1csc(-c2ccccn2)n1.
What is the InChIKey of N-pentan-3-yl-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide?
The InChIKey is HTKYALGPUZSVRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3OS/c1-3-11(4-2)17-14(19)9-12-10-20-15(18-12)13-7-5-6-8-16-13/h5-8,10-11H,3-4,9H2,1-2H3,(H,17,19).
What are the key properties of N-pentan-3-yl-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide?
N-pentan-3-yl-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide has a molecular weight of 289.40 g/mol, XLogP of 3.05, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-pentan-3-yl-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide is sourced from PubChem (CID 17434682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).