N-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]propanamide

C14H16N2O3S — CID 861937

IUPACN-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]propanamide
SMILESCCC(=O)Nc1nc(-c2cc(OC)ccc2OC)cs1
InChIInChI=1S/C14H16N2O3S/c1-4-13(17)16-14-15-11(8-20-14)10-7-9(18-2)5-6-12(10)19-3/h5-8H,4H2,1-3H3,(H,15,16,17)
InChIKeyZRVBJNKFYVWXBD-UHFFFAOYSA-N
MW292.36 g/mol
LogP3.18
Rot. Bonds5

About N-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]propanamide

N-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]propanamide (PubChem CID 861937) has the molecular formula C14H16N2O3S and a molecular weight of 292.36 g/mol. Its IUPAC name is N-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]propanamide.

Molecular Properties

Compound NameN-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]propanamide
PubChem CID861937
Molecular FormulaC14H16N2O3S
Molecular Weight292.36 g/mol
Exact Mass292.09
IUPAC NameN-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]propanamide
SMILESCCC(=O)Nc1nc(-c2cc(OC)ccc2OC)cs1
InChIInChI=1S/C14H16N2O3S/c1-4-13(17)16-14-15-11(8-20-14)10-7-9(18-2)5-6-12(10)19-3/h5-8H,4H2,1-3H3,(H,15,16,17)
InChIKeyZRVBJNKFYVWXBD-UHFFFAOYSA-N
XLogP3.18
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.36
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]-2-(4-methoxyphenyl)acetamide
CID 4263247
N-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]-2-(2-methoxyphenyl)acetamide
CID 2531414
N-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]-2-(2,3,4,5,6-pentafluorophenyl)acetamide
CID 24555291
N-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]-2-(tetrazol-1-yl)acetamide
CID 8873123
N-[4-(2,5-diethoxyphenyl)-1,3-thiazol-2-yl]propanamide
CID 17404839
[2-[[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]amino]-2-oxoethyl] 3,3-dimethylbutanoate
CID 7950691
N-[4-(2-methoxyphenyl)-1,3-thiazol-2-yl]propanamide
CID 4003372
N-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]-4-ethylbenzamide
CID 3255300
4-(2,5-dimethoxyphenyl)-N-ethyl-1,3-thiazol-2-amine
CID 8962407
N-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]-2-(4-methylphenyl)sulfanylacetamide
CID 7254533
3-cyclopentyl-N-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]propanamide
CID 8873226
N-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]-3-(2-methylpropoxy)propanamide
CID 38961150

Frequently Asked Questions

What is the IUPAC name of N-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]propanamide?
The IUPAC name of N-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]propanamide (CID 861937) is N-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]propanamide.
What is the SMILES notation for N-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]propanamide?
The canonical SMILES for N-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]propanamide is CCC(=O)Nc1nc(-c2cc(OC)ccc2OC)cs1.
What is the InChIKey of N-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]propanamide?
The InChIKey is ZRVBJNKFYVWXBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O3S/c1-4-13(17)16-14-15-11(8-20-14)10-7-9(18-2)5-6-12(10)19-3/h5-8H,4H2,1-3H3,(H,15,16,17).
What are the key properties of N-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]propanamide?
N-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]propanamide has a molecular weight of 292.36 g/mol, XLogP of 3.18, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]propanamide is sourced from PubChem (CID 861937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).