4-(2-methoxyethyl)-N-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]piperazine-1-carboxamide

C18H24N4O2S — CID 72933089

IUPAC4-(2-methoxyethyl)-N-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]piperazine-1-carboxamide
SMILESCOCCN1CCN(C(=O)Nc2cccc(-c3csc(C)n3)c2)CC1
InChIInChI=1S/C18H24N4O2S/c1-14-19-17(13-25-14)15-4-3-5-16(12-15)20-18(23)22-8-6-21(7-9-22)10-11-24-2/h3-5,12-13H,6-11H2,1-2H3,(H,20,23)
InChIKeyRJDVCIZQMWSUNO-UHFFFAOYSA-N
MW360.48 g/mol
LogP2.91
Rot. Bonds5

About 4-(2-methoxyethyl)-N-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]piperazine-1-carboxamide

4-(2-methoxyethyl)-N-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]piperazine-1-carboxamide (PubChem CID 72933089) has the molecular formula C18H24N4O2S and a molecular weight of 360.48 g/mol. Its IUPAC name is 4-(2-methoxyethyl)-N-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]piperazine-1-carboxamide.

Molecular Properties

Compound Name4-(2-methoxyethyl)-N-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]piperazine-1-carboxamide
PubChem CID72933089
Molecular FormulaC18H24N4O2S
Molecular Weight360.48 g/mol
Exact Mass360.16
IUPAC Name4-(2-methoxyethyl)-N-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]piperazine-1-carboxamide
SMILESCOCCN1CCN(C(=O)Nc2cccc(-c3csc(C)n3)c2)CC1
InChIInChI=1S/C18H24N4O2S/c1-14-19-17(13-25-14)15-4-3-5-16(12-15)20-18(23)22-8-6-21(7-9-22)10-11-24-2/h3-5,12-13H,6-11H2,1-2H3,(H,20,23)
InChIKeyRJDVCIZQMWSUNO-UHFFFAOYSA-N
XLogP2.91
TPSA57.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.48
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-methoxy-2-[(4-methylpiperazin-1-yl)methyl]-N-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide
CID 53307233
N-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]-3-pyrrolidin-1-ylpiperidine-1-carboxamide
CID 47049742
2,6-dimethoxy-N-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide
CID 99582165
(1S,5R)-8-(dimethylamino)-N-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]-3-azabicyclo[3.2.1]octane-3-carboxamide
CID 72899676
2-amino-N-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]acetamide
CID 43218994
N-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide
CID 766934
N-(2,6-dimethylphenyl)-4-(2-methoxyethyl)piperazine-1-carboxamide
CID 113104947
N-(3-methoxyphenyl)-4-[4-(3-methoxyphenyl)-1,3-thiazol-2-yl]piperazine-1-carboxamide
CID 1447625
2-(4-methoxyphenyl)-N-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]acetamide
CID 852161
N-(4-ethylphenyl)-4-(2-methoxyethyl)piperazine-1-carboxamide
CID 113104950
2-(3-methylpiperidin-1-yl)-N-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]acetamide
CID 46807539
methyl 3-[[4-(3-methoxypropyl)piperazine-1-carbonyl]amino]benzoate
CID 113105249

Frequently Asked Questions

What is the IUPAC name of 4-(2-methoxyethyl)-N-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]piperazine-1-carboxamide?
The IUPAC name of 4-(2-methoxyethyl)-N-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]piperazine-1-carboxamide (CID 72933089) is 4-(2-methoxyethyl)-N-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]piperazine-1-carboxamide.
What is the SMILES notation for 4-(2-methoxyethyl)-N-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]piperazine-1-carboxamide?
The canonical SMILES for 4-(2-methoxyethyl)-N-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]piperazine-1-carboxamide is COCCN1CCN(C(=O)Nc2cccc(-c3csc(C)n3)c2)CC1.
What is the InChIKey of 4-(2-methoxyethyl)-N-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]piperazine-1-carboxamide?
The InChIKey is RJDVCIZQMWSUNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N4O2S/c1-14-19-17(13-25-14)15-4-3-5-16(12-15)20-18(23)22-8-6-21(7-9-22)10-11-24-2/h3-5,12-13H,6-11H2,1-2H3,(H,20,23).
What are the key properties of 4-(2-methoxyethyl)-N-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]piperazine-1-carboxamide?
4-(2-methoxyethyl)-N-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]piperazine-1-carboxamide has a molecular weight of 360.48 g/mol, XLogP of 2.91, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methoxyethyl)-N-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]piperazine-1-carboxamide is sourced from PubChem (CID 72933089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).