N-[4-[4-[2-(4-ethylpiperazin-1-yl)-2-oxoethyl]-1,3-thiazol-2-yl]phenyl]acetamide

C19H24N4O2S — CID 110342188

IUPACN-[4-[4-[2-(4-ethylpiperazin-1-yl)-2-oxoethyl]-1,3-thiazol-2-yl]phenyl]acetamide
SMILESCCN1CCN(C(=O)Cc2csc(-c3ccc(NC(C)=O)cc3)n2)CC1
InChIInChI=1S/C19H24N4O2S/c1-3-22-8-10-23(11-9-22)18(25)12-17-13-26-19(21-17)15-4-6-16(7-5-15)20-14(2)24/h4-7,13H,3,8-12H2,1-2H3,(H,20,24)
InChIKeyUJMDVTORLXNROJ-UHFFFAOYSA-N
MW372.49 g/mol
LogP2.48
Rot. Bonds5

About N-[4-[4-[2-(4-ethylpiperazin-1-yl)-2-oxoethyl]-1,3-thiazol-2-yl]phenyl]acetamide

N-[4-[4-[2-(4-ethylpiperazin-1-yl)-2-oxoethyl]-1,3-thiazol-2-yl]phenyl]acetamide (PubChem CID 110342188) has the molecular formula C19H24N4O2S and a molecular weight of 372.49 g/mol. Its IUPAC name is N-[4-[4-[2-(4-ethylpiperazin-1-yl)-2-oxoethyl]-1,3-thiazol-2-yl]phenyl]acetamide.

Molecular Properties

Compound NameN-[4-[4-[2-(4-ethylpiperazin-1-yl)-2-oxoethyl]-1,3-thiazol-2-yl]phenyl]acetamide
PubChem CID110342188
Molecular FormulaC19H24N4O2S
Molecular Weight372.49 g/mol
Exact Mass372.16
IUPAC NameN-[4-[4-[2-(4-ethylpiperazin-1-yl)-2-oxoethyl]-1,3-thiazol-2-yl]phenyl]acetamide
SMILESCCN1CCN(C(=O)Cc2csc(-c3ccc(NC(C)=O)cc3)n2)CC1
InChIInChI=1S/C19H24N4O2S/c1-3-22-8-10-23(11-9-22)18(25)12-17-13-26-19(21-17)15-4-6-16(7-5-15)20-14(2)24/h4-7,13H,3,8-12H2,1-2H3,(H,20,24)
InChIKeyUJMDVTORLXNROJ-UHFFFAOYSA-N
XLogP2.48
TPSA65.54 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.49
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(4-ethylpiperazin-1-yl)-2-[4-(2-pyridin-4-yl-1,3-thiazol-4-yl)phenyl]ethanone
CID 110300182
1-(4-butan-2-ylpiperazin-1-yl)-2-[2-(4-methylphenyl)-1,3-thiazol-4-yl]ethanone
CID 154784489
2-[2-(4-methylphenyl)-1,3-thiazol-4-yl]-1-piperazin-1-ylethanone
CID 39305192
1-(4-benzyl-1,4-diazepan-1-yl)-2-[2-(4-ethylphenyl)-1,3-thiazol-4-yl]ethanone
CID 112803915
N-propyl-2-[4-[2-[2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-4-yl]acetyl]piperazin-1-yl]acetamide
CID 55516393
N-[4-(4-ethylpiperazin-1-yl)-3-methylphenyl]-2-[2-(4-methylphenyl)-1,3-thiazol-4-yl]acetamide
CID 24525541
N-[2-[2-(4-acetamidophenyl)-1,3-thiazol-4-yl]ethyl]acetamide
CID 110351882
N-[4-[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]-1,3-thiazol-2-yl]acetamide
CID 29173280
1-(4-ethylpiperazin-1-yl)-2-[2-(morpholin-4-ylmethyl)-1,3-thiazol-4-yl]ethanone
CID 110386954
N-(2-methoxyethyl)-2-[4-[2-(2-phenyl-1,3-thiazol-4-yl)acetyl]piperazin-1-yl]acetamide
CID 78817443
2-[2-(4-ethoxyphenyl)-1,3-thiazol-4-yl]-1-[4-(2-phenylethyl)piperazin-1-yl]ethanone
CID 55585106
ethyl N-[2-[2-(4-acetamidophenyl)-1,3-thiazol-4-yl]ethyl]carbamate
CID 110351919

Frequently Asked Questions

What is the IUPAC name of N-[4-[4-[2-(4-ethylpiperazin-1-yl)-2-oxoethyl]-1,3-thiazol-2-yl]phenyl]acetamide?
The IUPAC name of N-[4-[4-[2-(4-ethylpiperazin-1-yl)-2-oxoethyl]-1,3-thiazol-2-yl]phenyl]acetamide (CID 110342188) is N-[4-[4-[2-(4-ethylpiperazin-1-yl)-2-oxoethyl]-1,3-thiazol-2-yl]phenyl]acetamide.
What is the SMILES notation for N-[4-[4-[2-(4-ethylpiperazin-1-yl)-2-oxoethyl]-1,3-thiazol-2-yl]phenyl]acetamide?
The canonical SMILES for N-[4-[4-[2-(4-ethylpiperazin-1-yl)-2-oxoethyl]-1,3-thiazol-2-yl]phenyl]acetamide is CCN1CCN(C(=O)Cc2csc(-c3ccc(NC(C)=O)cc3)n2)CC1.
What is the InChIKey of N-[4-[4-[2-(4-ethylpiperazin-1-yl)-2-oxoethyl]-1,3-thiazol-2-yl]phenyl]acetamide?
The InChIKey is UJMDVTORLXNROJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O2S/c1-3-22-8-10-23(11-9-22)18(25)12-17-13-26-19(21-17)15-4-6-16(7-5-15)20-14(2)24/h4-7,13H,3,8-12H2,1-2H3,(H,20,24).
What are the key properties of N-[4-[4-[2-(4-ethylpiperazin-1-yl)-2-oxoethyl]-1,3-thiazol-2-yl]phenyl]acetamide?
N-[4-[4-[2-(4-ethylpiperazin-1-yl)-2-oxoethyl]-1,3-thiazol-2-yl]phenyl]acetamide has a molecular weight of 372.49 g/mol, XLogP of 2.48, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[4-[2-(4-ethylpiperazin-1-yl)-2-oxoethyl]-1,3-thiazol-2-yl]phenyl]acetamide is sourced from PubChem (CID 110342188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).