N-[4-(2,5-diethoxyphenyl)-1,3-thiazol-2-yl]acetamide

C15H18N2O3S — CID 17404838

IUPACN-[4-(2,5-diethoxyphenyl)-1,3-thiazol-2-yl]acetamide
SMILESCCOc1ccc(OCC)c(-c2csc(NC(C)=O)n2)c1
InChIInChI=1S/C15H18N2O3S/c1-4-19-11-6-7-14(20-5-2)12(8-11)13-9-21-15(17-13)16-10(3)18/h6-9H,4-5H2,1-3H3,(H,16,17,18)
InChIKeyYDFHWEMLGFCKHQ-UHFFFAOYSA-N
MW306.39 g/mol
LogP3.57
Rot. Bonds6

About N-[4-(2,5-diethoxyphenyl)-1,3-thiazol-2-yl]acetamide

N-[4-(2,5-diethoxyphenyl)-1,3-thiazol-2-yl]acetamide (PubChem CID 17404838) has the molecular formula C15H18N2O3S and a molecular weight of 306.39 g/mol. Its IUPAC name is N-[4-(2,5-diethoxyphenyl)-1,3-thiazol-2-yl]acetamide.

Molecular Properties

Compound NameN-[4-(2,5-diethoxyphenyl)-1,3-thiazol-2-yl]acetamide
PubChem CID17404838
Molecular FormulaC15H18N2O3S
Molecular Weight306.39 g/mol
Exact Mass306.10
IUPAC NameN-[4-(2,5-diethoxyphenyl)-1,3-thiazol-2-yl]acetamide
SMILESCCOc1ccc(OCC)c(-c2csc(NC(C)=O)n2)c1
InChIInChI=1S/C15H18N2O3S/c1-4-19-11-6-7-14(20-5-2)12(8-11)13-9-21-15(17-13)16-10(3)18/h6-9H,4-5H2,1-3H3,(H,16,17,18)
InChIKeyYDFHWEMLGFCKHQ-UHFFFAOYSA-N
XLogP3.57
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.39
LogP ≤ 53.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[4-(2,5-diethoxyphenyl)-1,3-thiazol-2-yl]propanamide
CID 17404839
(3S)-N-[4-(2,5-diethoxyphenyl)-1,3-thiazol-2-yl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide
CID 41179838
(3R)-N-[4-(2,5-diethoxyphenyl)-1,3-thiazol-2-yl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide
CID 41179839
N-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]propanamide
CID 861937
N-[4-(8-ethoxy-2-oxochromen-3-yl)-1,3-thiazol-2-yl]acetamide
CID 4098996
N-[4-(2,5-dimethylfuran-3-yl)-1,3-thiazol-2-yl]acetamide
CID 47066446
2-chloro-N-[4-(2-ethoxyphenyl)-1,3-thiazol-2-yl]acetamide
CID 19194825
N-[4-(2-ethoxyphenyl)-1,3-thiazol-2-yl]benzamide
CID 735075
N-[4-(2-ethoxyphenyl)-1,3-thiazol-2-yl]-2-(4-methylphenoxy)propanamide
CID 55895475
2,2-dichloro-N-[4-(2-ethoxyphenyl)-1,3-thiazol-2-yl]acetamide
CID 19194831
N-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]-2-(4-methoxyphenyl)acetamide
CID 4263247
N-[4-(2-ethoxyphenyl)-1,3-thiazol-2-yl]-2-(4-propylphenoxy)acetamide
CID 19196497

Frequently Asked Questions

What is the IUPAC name of N-[4-(2,5-diethoxyphenyl)-1,3-thiazol-2-yl]acetamide?
The IUPAC name of N-[4-(2,5-diethoxyphenyl)-1,3-thiazol-2-yl]acetamide (CID 17404838) is N-[4-(2,5-diethoxyphenyl)-1,3-thiazol-2-yl]acetamide.
What is the SMILES notation for N-[4-(2,5-diethoxyphenyl)-1,3-thiazol-2-yl]acetamide?
The canonical SMILES for N-[4-(2,5-diethoxyphenyl)-1,3-thiazol-2-yl]acetamide is CCOc1ccc(OCC)c(-c2csc(NC(C)=O)n2)c1.
What is the InChIKey of N-[4-(2,5-diethoxyphenyl)-1,3-thiazol-2-yl]acetamide?
The InChIKey is YDFHWEMLGFCKHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O3S/c1-4-19-11-6-7-14(20-5-2)12(8-11)13-9-21-15(17-13)16-10(3)18/h6-9H,4-5H2,1-3H3,(H,16,17,18).
What are the key properties of N-[4-(2,5-diethoxyphenyl)-1,3-thiazol-2-yl]acetamide?
N-[4-(2,5-diethoxyphenyl)-1,3-thiazol-2-yl]acetamide has a molecular weight of 306.39 g/mol, XLogP of 3.57, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2,5-diethoxyphenyl)-1,3-thiazol-2-yl]acetamide is sourced from PubChem (CID 17404838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).