N-[2-(4-pyridin-4-yl-1,3-thiazol-2-yl)ethyl]pentanamide

C15H19N3OS — CID 110317749

IUPACN-[2-(4-pyridin-4-yl-1,3-thiazol-2-yl)ethyl]pentanamide
SMILESCCCCC(=O)NCCc1nc(-c2ccncc2)cs1
InChIInChI=1S/C15H19N3OS/c1-2-3-4-14(19)17-10-7-15-18-13(11-20-15)12-5-8-16-9-6-12/h5-6,8-9,11H,2-4,7,10H2,1H3,(H,17,19)
InChIKeyNYRVMSMXQHXBAT-UHFFFAOYSA-N
MW289.40 g/mol
LogP3.05
Rot. Bonds7

About N-[2-(4-pyridin-4-yl-1,3-thiazol-2-yl)ethyl]pentanamide

N-[2-(4-pyridin-4-yl-1,3-thiazol-2-yl)ethyl]pentanamide (PubChem CID 110317749) has the molecular formula C15H19N3OS and a molecular weight of 289.40 g/mol. Its IUPAC name is N-[2-(4-pyridin-4-yl-1,3-thiazol-2-yl)ethyl]pentanamide.

Molecular Properties

Compound NameN-[2-(4-pyridin-4-yl-1,3-thiazol-2-yl)ethyl]pentanamide
PubChem CID110317749
Molecular FormulaC15H19N3OS
Molecular Weight289.40 g/mol
Exact Mass289.12
IUPAC NameN-[2-(4-pyridin-4-yl-1,3-thiazol-2-yl)ethyl]pentanamide
SMILESCCCCC(=O)NCCc1nc(-c2ccncc2)cs1
InChIInChI=1S/C15H19N3OS/c1-2-3-4-14(19)17-10-7-15-18-13(11-20-15)12-5-8-16-9-6-12/h5-6,8-9,11H,2-4,7,10H2,1H3,(H,17,19)
InChIKeyNYRVMSMXQHXBAT-UHFFFAOYSA-N
XLogP3.05
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
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

Analyze N-[2-(4-pyridin-4-yl-1,3-thiazol-2-yl)ethyl]pentanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-propyl-3-(4-pyridin-4-yl-1,3-thiazol-2-yl)propanamide
CID 110647210
4-amino-N-[3-(4-pyridin-4-yl-1,3-thiazol-2-yl)propyl]butanamide;dihydrochloride
CID 119875531
ethyl 2-oxo-2-[2-(4-pyridin-4-yl-1,3-thiazol-2-yl)ethylamino]acetate
CID 110317808
N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]pentanamide
CID 39071897
(2R)-2-amino-N-[2-(4-pyridin-4-yl-1,3-thiazol-2-yl)ethyl]propanamide;dihydrochloride
CID 119874734
2-(methylamino)-N-[3-(4-pyridin-4-yl-1,3-thiazol-2-yl)propyl]acetamide;hydrochloride
CID 120704270
N-[2-(2-methoxyphenyl)ethyl]-3-(4-pyridin-4-yl-1,3-thiazol-2-yl)propanamide
CID 110648445
N-[3-[2-(4-pyridin-4-yl-1,3-thiazol-2-yl)ethylamino]propyl]acetamide
CID 82103538
3-(dimethylamino)-N-[2-(4-phenyl-1,3-thiazol-2-yl)ethyl]propanamide
CID 110442461
3-(2-aminophenyl)-N-[3-(4-pyridin-4-yl-1,3-thiazol-2-yl)propyl]propanamide;dihydrochloride
CID 120612941
2-[2-(heptanoylamino)ethyl]-1,3-thiazole-4-carboxylic acid
CID 66374838
1-phenyl-3-[2-(4-pyridin-4-yl-1,3-thiazol-2-yl)ethyl]urea
CID 110317790

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-pyridin-4-yl-1,3-thiazol-2-yl)ethyl]pentanamide?
The IUPAC name of N-[2-(4-pyridin-4-yl-1,3-thiazol-2-yl)ethyl]pentanamide (CID 110317749) is N-[2-(4-pyridin-4-yl-1,3-thiazol-2-yl)ethyl]pentanamide.
What is the SMILES notation for N-[2-(4-pyridin-4-yl-1,3-thiazol-2-yl)ethyl]pentanamide?
The canonical SMILES for N-[2-(4-pyridin-4-yl-1,3-thiazol-2-yl)ethyl]pentanamide is CCCCC(=O)NCCc1nc(-c2ccncc2)cs1.
What is the InChIKey of N-[2-(4-pyridin-4-yl-1,3-thiazol-2-yl)ethyl]pentanamide?
The InChIKey is NYRVMSMXQHXBAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3OS/c1-2-3-4-14(19)17-10-7-15-18-13(11-20-15)12-5-8-16-9-6-12/h5-6,8-9,11H,2-4,7,10H2,1H3,(H,17,19).
What are the key properties of N-[2-(4-pyridin-4-yl-1,3-thiazol-2-yl)ethyl]pentanamide?
N-[2-(4-pyridin-4-yl-1,3-thiazol-2-yl)ethyl]pentanamide has a molecular weight of 289.40 g/mol, XLogP of 3.05, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-pyridin-4-yl-1,3-thiazol-2-yl)ethyl]pentanamide is sourced from PubChem (CID 110317749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).