N-[3-[4-(4-ethylpiperazine-1-carbonyl)-5-methyl-1,3-thiazol-2-yl]phenyl]acetamide

C19H24N4O2S — CID 110342446

IUPACN-[3-[4-(4-ethylpiperazine-1-carbonyl)-5-methyl-1,3-thiazol-2-yl]phenyl]acetamide
SMILESCCN1CCN(C(=O)c2nc(-c3cccc(NC(C)=O)c3)sc2C)CC1
InChIInChI=1S/C19H24N4O2S/c1-4-22-8-10-23(11-9-22)19(25)17-13(2)26-18(21-17)15-6-5-7-16(12-15)20-14(3)24/h5-7,12H,4,8-11H2,1-3H3,(H,20,24)
InChIKeyQATXCKFIRXZIFN-UHFFFAOYSA-N
MW372.49 g/mol
LogP2.85
Rot. Bonds4

About N-[3-[4-(4-ethylpiperazine-1-carbonyl)-5-methyl-1,3-thiazol-2-yl]phenyl]acetamide

N-[3-[4-(4-ethylpiperazine-1-carbonyl)-5-methyl-1,3-thiazol-2-yl]phenyl]acetamide (PubChem CID 110342446) has the molecular formula C19H24N4O2S and a molecular weight of 372.49 g/mol. Its IUPAC name is N-[3-[4-(4-ethylpiperazine-1-carbonyl)-5-methyl-1,3-thiazol-2-yl]phenyl]acetamide.

Molecular Properties

Compound NameN-[3-[4-(4-ethylpiperazine-1-carbonyl)-5-methyl-1,3-thiazol-2-yl]phenyl]acetamide
PubChem CID110342446
Molecular FormulaC19H24N4O2S
Molecular Weight372.49 g/mol
Exact Mass372.16
IUPAC NameN-[3-[4-(4-ethylpiperazine-1-carbonyl)-5-methyl-1,3-thiazol-2-yl]phenyl]acetamide
SMILESCCN1CCN(C(=O)c2nc(-c3cccc(NC(C)=O)c3)sc2C)CC1
InChIInChI=1S/C19H24N4O2S/c1-4-22-8-10-23(11-9-22)19(25)17-13(2)26-18(21-17)15-6-5-7-16(12-15)20-14(3)24/h5-7,12H,4,8-11H2,1-3H3,(H,20,24)
InChIKeyQATXCKFIRXZIFN-UHFFFAOYSA-N
XLogP2.85
TPSA65.54 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.49
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[3-[[3-(4-ethylpiperazin-1-yl)-3-oxopropyl]sulfonylamino]phenyl]acetamide
CID 110408469
N-[4-[4-[2-(4-ethylpiperazin-1-yl)-2-oxoethyl]-1,3-thiazol-2-yl]phenyl]acetamide
CID 110342188
N-[3-(4-ethylpiperazine-1-carbonyl)-4-methoxyphenyl]acetamide
CID 110764459
(2-anilino-6-methylpyrimidin-4-yl)-(4-ethylpiperazin-1-yl)methanone
CID 109326196
3-(4-ethylpiperazine-1-carbonyl)-N-(3-methylphenyl)imidazo[1,5-a]pyridine-1-carboxamide
CID 109070034
3,4-dihydro-1H-isoquinolin-2-yl-(5-methyl-2-phenyl-1,3-thiazol-4-yl)methanone
CID 110648378
N-[4-[[5-(4-ethylpiperazine-1-carbonyl)pyrimidin-2-yl]amino]phenyl]acetamide
CID 109254112
[2-(furan-2-yl)-5-methyl-1,3-thiazol-4-yl]-[4-[(2S)-2-hydroxypropyl]piperazin-1-yl]methanone
CID 95326170
N-[3-(5-chloro-7-morpholin-4-yl-[1,3]thiazolo[5,4-d]pyrimidin-2-yl)phenyl]acetamide
CID 86630074
N-[3-[4-(2-aminoethyl)piperazine-1-carbonyl]phenyl]acetamide
CID 82354357
N-[2-[2-(3-acetamidophenyl)-1,3-thiazol-4-yl]ethyl]morpholine-4-carboxamide
CID 110351972
2-[4-[2-(furan-2-yl)-5-methyl-1,3-thiazole-4-carbonyl]piperazin-1-yl]-1-pyrrolidin-1-ylethanone
CID 39462105

Frequently Asked Questions

What is the IUPAC name of N-[3-[4-(4-ethylpiperazine-1-carbonyl)-5-methyl-1,3-thiazol-2-yl]phenyl]acetamide?
The IUPAC name of N-[3-[4-(4-ethylpiperazine-1-carbonyl)-5-methyl-1,3-thiazol-2-yl]phenyl]acetamide (CID 110342446) is N-[3-[4-(4-ethylpiperazine-1-carbonyl)-5-methyl-1,3-thiazol-2-yl]phenyl]acetamide.
What is the SMILES notation for N-[3-[4-(4-ethylpiperazine-1-carbonyl)-5-methyl-1,3-thiazol-2-yl]phenyl]acetamide?
The canonical SMILES for N-[3-[4-(4-ethylpiperazine-1-carbonyl)-5-methyl-1,3-thiazol-2-yl]phenyl]acetamide is CCN1CCN(C(=O)c2nc(-c3cccc(NC(C)=O)c3)sc2C)CC1.
What is the InChIKey of N-[3-[4-(4-ethylpiperazine-1-carbonyl)-5-methyl-1,3-thiazol-2-yl]phenyl]acetamide?
The InChIKey is QATXCKFIRXZIFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O2S/c1-4-22-8-10-23(11-9-22)19(25)17-13(2)26-18(21-17)15-6-5-7-16(12-15)20-14(3)24/h5-7,12H,4,8-11H2,1-3H3,(H,20,24).
What are the key properties of N-[3-[4-(4-ethylpiperazine-1-carbonyl)-5-methyl-1,3-thiazol-2-yl]phenyl]acetamide?
N-[3-[4-(4-ethylpiperazine-1-carbonyl)-5-methyl-1,3-thiazol-2-yl]phenyl]acetamide has a molecular weight of 372.49 g/mol, XLogP of 2.85, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[4-(4-ethylpiperazine-1-carbonyl)-5-methyl-1,3-thiazol-2-yl]phenyl]acetamide is sourced from PubChem (CID 110342446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).