N-[4-(4-methoxyphenyl)-5-methyl-1,3-thiazol-2-yl]-5-methyl-4-propylthiophene-2-carboxamide

C20H22N2O2S2 — CID 7916066

IUPACN-[4-(4-methoxyphenyl)-5-methyl-1,3-thiazol-2-yl]-5-methyl-4-propylthiophene-2-carboxamide
SMILESCCCc1cc(C(=O)Nc2nc(-c3ccc(OC)cc3)c(C)s2)sc1C
InChIInChI=1S/C20H22N2O2S2/c1-5-6-15-11-17(25-12(15)2)19(23)22-20-21-18(13(3)26-20)14-7-9-16(24-4)10-8-14/h7-11H,5-6H2,1-4H3,(H,21,22,23)
InChIKeyFCLIIRNITMEQIT-UHFFFAOYSA-N
MW386.54 g/mol
LogP5.70
Rot. Bonds6

About N-[4-(4-methoxyphenyl)-5-methyl-1,3-thiazol-2-yl]-5-methyl-4-propylthiophene-2-carboxamide

N-[4-(4-methoxyphenyl)-5-methyl-1,3-thiazol-2-yl]-5-methyl-4-propylthiophene-2-carboxamide (PubChem CID 7916066) has the molecular formula C20H22N2O2S2 and a molecular weight of 386.54 g/mol. Its IUPAC name is N-[4-(4-methoxyphenyl)-5-methyl-1,3-thiazol-2-yl]-5-methyl-4-propylthiophene-2-carboxamide.

Molecular Properties

Compound NameN-[4-(4-methoxyphenyl)-5-methyl-1,3-thiazol-2-yl]-5-methyl-4-propylthiophene-2-carboxamide
PubChem CID7916066
Molecular FormulaC20H22N2O2S2
Molecular Weight386.54 g/mol
Exact Mass386.11
IUPAC NameN-[4-(4-methoxyphenyl)-5-methyl-1,3-thiazol-2-yl]-5-methyl-4-propylthiophene-2-carboxamide
SMILESCCCc1cc(C(=O)Nc2nc(-c3ccc(OC)cc3)c(C)s2)sc1C
InChIInChI=1S/C20H22N2O2S2/c1-5-6-15-11-17(25-12(15)2)19(23)22-20-21-18(13(3)26-20)14-7-9-16(24-4)10-8-14/h7-11H,5-6H2,1-4H3,(H,21,22,23)
InChIKeyFCLIIRNITMEQIT-UHFFFAOYSA-N
XLogP5.70
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500386.54
LogP ≤ 55.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[4-(4-methoxyphenyl)-5-methyl-1,3-thiazol-2-yl]-5-methylthiophene-2-carboxamide
CID 4812490
4-tert-butyl-N-[4-(4-methoxyphenyl)-5-methyl-1,3-thiazol-2-yl]benzamide
CID 1315978
N-[4-(4-methoxyphenyl)-5-methyl-1,3-thiazol-2-yl]-2-methylpropanamide
CID 4615365
4-ethyl-N-(6-methoxy-1,3-benzothiazol-2-yl)-5-methylthiophene-2-carboxamide
CID 24564369
N-[4-(4-methoxyphenyl)-5-methyl-1,3-thiazol-2-yl]-3-methylthiophene-2-carboxamide
CID 7916082
N-[4-(4-methoxyphenyl)-5-methyl-1,3-thiazol-2-yl]-2-methylbenzamide
CID 3260995
N-[4-(4-methoxyphenyl)-5-methyl-1,3-thiazol-2-yl]-6-methylpyridine-2-carboxamide
CID 32939841
N-[4-(4-ethoxyphenyl)-5-methyl-1,3-thiazol-2-yl]-3-methoxybenzamide
CID 5203850
N-[4-(4-acetamidophenyl)-1,3-thiazol-2-yl]-5-methyl-4-propylthiophene-2-carboxamide
CID 26893935
N-[4-(4-methoxyphenyl)-5-propyl-1,3-thiazol-2-yl]thiophene-2-carboxamide
CID 1348974
3-(2,5-dimethoxyphenyl)-N-[4-(4-methoxyphenyl)-5-methyl-1,3-thiazol-2-yl]propanamide
CID 38041071
4-chloro-N-[4-(4-methoxyphenyl)-5-methyl-1,3-thiazol-2-yl]pyridine-2-carboxamide
CID 7598306

Frequently Asked Questions

What is the IUPAC name of N-[4-(4-methoxyphenyl)-5-methyl-1,3-thiazol-2-yl]-5-methyl-4-propylthiophene-2-carboxamide?
The IUPAC name of N-[4-(4-methoxyphenyl)-5-methyl-1,3-thiazol-2-yl]-5-methyl-4-propylthiophene-2-carboxamide (CID 7916066) is N-[4-(4-methoxyphenyl)-5-methyl-1,3-thiazol-2-yl]-5-methyl-4-propylthiophene-2-carboxamide.
What is the SMILES notation for N-[4-(4-methoxyphenyl)-5-methyl-1,3-thiazol-2-yl]-5-methyl-4-propylthiophene-2-carboxamide?
The canonical SMILES for N-[4-(4-methoxyphenyl)-5-methyl-1,3-thiazol-2-yl]-5-methyl-4-propylthiophene-2-carboxamide is CCCc1cc(C(=O)Nc2nc(-c3ccc(OC)cc3)c(C)s2)sc1C.
What is the InChIKey of N-[4-(4-methoxyphenyl)-5-methyl-1,3-thiazol-2-yl]-5-methyl-4-propylthiophene-2-carboxamide?
The InChIKey is FCLIIRNITMEQIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N2O2S2/c1-5-6-15-11-17(25-12(15)2)19(23)22-20-21-18(13(3)26-20)14-7-9-16(24-4)10-8-14/h7-11H,5-6H2,1-4H3,(H,21,22,23).
What are the key properties of N-[4-(4-methoxyphenyl)-5-methyl-1,3-thiazol-2-yl]-5-methyl-4-propylthiophene-2-carboxamide?
N-[4-(4-methoxyphenyl)-5-methyl-1,3-thiazol-2-yl]-5-methyl-4-propylthiophene-2-carboxamide has a molecular weight of 386.54 g/mol, XLogP of 5.70, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(4-methoxyphenyl)-5-methyl-1,3-thiazol-2-yl]-5-methyl-4-propylthiophene-2-carboxamide is sourced from PubChem (CID 7916066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).