N-[2-(diethylamino)ethyl]-2-(2,5-dimethyl-1,3-thiazol-4-yl)acetamide

C13H23N3OS — CID 91484769

IUPACN-[2-(diethylamino)ethyl]-2-(2,5-dimethyl-1,3-thiazol-4-yl)acetamide
SMILESCCN(CC)CCNC(=O)Cc1nc(C)sc1C
InChIInChI=1S/C13H23N3OS/c1-5-16(6-2)8-7-14-13(17)9-12-10(3)18-11(4)15-12/h5-9H2,1-4H3,(H,14,17)
InChIKeySVWXERLXFLHPDJ-UHFFFAOYSA-N
MW269.41 g/mol
LogP1.76
Rot. Bonds7

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

N-[2-(diethylamino)ethyl]-2-(2,5-dimethyl-1,3-thiazol-4-yl)acetamide (PubChem CID 91484769) has the molecular formula C13H23N3OS and a molecular weight of 269.41 g/mol. Its IUPAC name is N-[2-(diethylamino)ethyl]-2-(2,5-dimethyl-1,3-thiazol-4-yl)acetamide.

Molecular Properties

Compound NameN-[2-(diethylamino)ethyl]-2-(2,5-dimethyl-1,3-thiazol-4-yl)acetamide
PubChem CID91484769
Molecular FormulaC13H23N3OS
Molecular Weight269.41 g/mol
Exact Mass269.16
IUPAC NameN-[2-(diethylamino)ethyl]-2-(2,5-dimethyl-1,3-thiazol-4-yl)acetamide
SMILESCCN(CC)CCNC(=O)Cc1nc(C)sc1C
InChIInChI=1S/C13H23N3OS/c1-5-16(6-2)8-7-14-13(17)9-12-10(3)18-11(4)15-12/h5-9H2,1-4H3,(H,14,17)
InChIKeySVWXERLXFLHPDJ-UHFFFAOYSA-N
XLogP1.76
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.41
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2,5-dimethyl-1,3-thiazol-4-yl)-N-(2-pyrrolidin-1-ylethyl)acetamide
CID 143940533
N-[2-(diethylamino)ethyl]-2-(4-hydroxyphenyl)acetamide
CID 110463127
2-(2,5-dimethyl-1,3-thiazol-4-yl)-N-[2-(4-methyl-5-oxo-1H-1,2,4-triazol-3-yl)ethyl]acetamide
CID 91842009
N-[2-(diethylamino)ethyl]-2-[2-(4-methylphenyl)-1,3-thiazol-4-yl]acetamide
CID 86906795
N-[2-(diethylamino)ethyl]-2-(3-methylphenyl)acetamide
CID 17144542
2-(2,5-dimethyl-1,3-thiazol-4-yl)-N-[2-(3-phenylpiperidin-1-yl)ethyl]acetamide
CID 91834161
2-[2-(1-aminoethyl)-1,3-thiazol-4-yl]-N-[2-(diethylamino)ethyl]acetamide
CID 82547658
N-[2-[ethyl(propyl)amino]ethyl]-2-(4-methyl-2-sulfanylidene-3H-1,3-thiazol-5-yl)acetamide
CID 103719302
2-(4-acetamidophenyl)-N-[2-(diethylamino)ethyl]acetamide
CID 108792640
2-(2,5-dimethyl-1,3-thiazol-4-yl)-N-[(4S)-4-methoxypyrrolidin-3-yl]acetamide
CID 91660071
ethyl 4-[2-(diethylamino)ethylcarbamoyl]-1,3-thiazole-2-carboxylate
CID 116697620
N-[2-(diethylamino)ethyl]-2-sulfanylidene-3H-1,3,4-thiadiazole-5-carboxamide
CID 54229358

Frequently Asked Questions

What is the IUPAC name of N-[2-(diethylamino)ethyl]-2-(2,5-dimethyl-1,3-thiazol-4-yl)acetamide?
The IUPAC name of N-[2-(diethylamino)ethyl]-2-(2,5-dimethyl-1,3-thiazol-4-yl)acetamide (CID 91484769) is N-[2-(diethylamino)ethyl]-2-(2,5-dimethyl-1,3-thiazol-4-yl)acetamide.
What is the SMILES notation for N-[2-(diethylamino)ethyl]-2-(2,5-dimethyl-1,3-thiazol-4-yl)acetamide?
The canonical SMILES for N-[2-(diethylamino)ethyl]-2-(2,5-dimethyl-1,3-thiazol-4-yl)acetamide is CCN(CC)CCNC(=O)Cc1nc(C)sc1C.
What is the InChIKey of N-[2-(diethylamino)ethyl]-2-(2,5-dimethyl-1,3-thiazol-4-yl)acetamide?
The InChIKey is SVWXERLXFLHPDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3OS/c1-5-16(6-2)8-7-14-13(17)9-12-10(3)18-11(4)15-12/h5-9H2,1-4H3,(H,14,17).
What are the key properties of N-[2-(diethylamino)ethyl]-2-(2,5-dimethyl-1,3-thiazol-4-yl)acetamide?
N-[2-(diethylamino)ethyl]-2-(2,5-dimethyl-1,3-thiazol-4-yl)acetamide has a molecular weight of 269.41 g/mol, XLogP of 1.76, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(diethylamino)ethyl]-2-(2,5-dimethyl-1,3-thiazol-4-yl)acetamide is sourced from PubChem (CID 91484769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).