N-[[2-(4-methoxyphenyl)-4,6-dimethyl-3-pyridinyl]methyl]thiophene-2-carboxamide

C20H20N2O2S — CID 53148145

IUPACN-[[2-(4-methoxyphenyl)-4,6-dimethyl-3-pyridinyl]methyl]thiophene-2-carboxamide
SMILESCOc1ccc(-c2nc(C)cc(C)c2CNC(=O)c2cccs2)cc1
InChIInChI=1S/C20H20N2O2S/c1-13-11-14(2)22-19(15-6-8-16(24-3)9-7-15)17(13)12-21-20(23)18-5-4-10-25-18/h4-11H,12H2,1-3H3,(H,21,23)
InChIKeyPPOSXBDPAQIJEL-UHFFFAOYSA-N
MW352.46 g/mol
LogP4.37
Rot. Bonds5

About N-[[2-(4-methoxyphenyl)-4,6-dimethyl-3-pyridinyl]methyl]thiophene-2-carboxamide

N-[[2-(4-methoxyphenyl)-4,6-dimethyl-3-pyridinyl]methyl]thiophene-2-carboxamide (PubChem CID 53148145) has the molecular formula C20H20N2O2S and a molecular weight of 352.46 g/mol. Its IUPAC name is N-[[2-(4-methoxyphenyl)-4,6-dimethyl-3-pyridinyl]methyl]thiophene-2-carboxamide.

Molecular Properties

Compound NameN-[[2-(4-methoxyphenyl)-4,6-dimethyl-3-pyridinyl]methyl]thiophene-2-carboxamide
PubChem CID53148145
Molecular FormulaC20H20N2O2S
Molecular Weight352.46 g/mol
Exact Mass352.12
IUPAC NameN-[[2-(4-methoxyphenyl)-4,6-dimethyl-3-pyridinyl]methyl]thiophene-2-carboxamide
SMILESCOc1ccc(-c2nc(C)cc(C)c2CNC(=O)c2cccs2)cc1
InChIInChI=1S/C20H20N2O2S/c1-13-11-14(2)22-19(15-6-8-16(24-3)9-7-15)17(13)12-21-20(23)18-5-4-10-25-18/h4-11H,12H2,1-3H3,(H,21,23)
InChIKeyPPOSXBDPAQIJEL-UHFFFAOYSA-N
XLogP4.37
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.46
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[[2-(4-methoxyphenyl)-4,6-dimethyl-3-pyridinyl]methyl]thiophene-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[[2-(4-methoxyphenyl)-4,6-dimethyl-3-pyridinyl]methyl]benzamide
CID 53148143
2-(4-methoxyphenyl)-N-[[2-(4-methoxyphenyl)-4,6-dimethyl-3-pyridinyl]methyl]acetamide
CID 53148125
2-(3-methoxyphenyl)-N-[[2-(4-methoxyphenyl)-4,6-dimethyl-3-pyridinyl]methyl]acetamide
CID 53148124
N-[[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]methyl]thiophene-2-carboxamide
CID 110320093
N-[(5-methoxy-1,3-dimethylpyrazol-4-yl)methyl]thiophene-2-carboxamide
CID 75484362
N-[5-(4-methoxyphenyl)-4-phenyl-1,3-thiazol-2-yl]thiophene-2-carboxamide
CID 2281805
N-[4-(4-methoxyphenyl)-5-propyl-1,3-thiazol-2-yl]thiophene-2-carboxamide
CID 1348974
N-[(4-methyl-6-pyrrolidin-1-ylpyrimidin-2-yl)methyl]thiophene-2-carboxamide
CID 71807389
N-[(4-methoxyphenyl)methyl]-1-methyl-5-(thiophene-2-carbonylamino)pyrazole-3-carboxamide
CID 51999191
N-[(4-methyl-6-piperidin-1-ylpyrimidin-2-yl)methyl]thiophene-2-carboxamide
CID 122318073
N-[(2-methoxyphenyl)methyl]thiophene-2-carboxamide
CID 755236
N-[[1-[(4-methoxyphenyl)methyl]benzimidazol-2-yl]methyl]thiophene-2-carboxamide
CID 16973758

Frequently Asked Questions

What is the IUPAC name of N-[[2-(4-methoxyphenyl)-4,6-dimethyl-3-pyridinyl]methyl]thiophene-2-carboxamide?
The IUPAC name of N-[[2-(4-methoxyphenyl)-4,6-dimethyl-3-pyridinyl]methyl]thiophene-2-carboxamide (CID 53148145) is N-[[2-(4-methoxyphenyl)-4,6-dimethyl-3-pyridinyl]methyl]thiophene-2-carboxamide.
What is the SMILES notation for N-[[2-(4-methoxyphenyl)-4,6-dimethyl-3-pyridinyl]methyl]thiophene-2-carboxamide?
The canonical SMILES for N-[[2-(4-methoxyphenyl)-4,6-dimethyl-3-pyridinyl]methyl]thiophene-2-carboxamide is COc1ccc(-c2nc(C)cc(C)c2CNC(=O)c2cccs2)cc1.
What is the InChIKey of N-[[2-(4-methoxyphenyl)-4,6-dimethyl-3-pyridinyl]methyl]thiophene-2-carboxamide?
The InChIKey is PPOSXBDPAQIJEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N2O2S/c1-13-11-14(2)22-19(15-6-8-16(24-3)9-7-15)17(13)12-21-20(23)18-5-4-10-25-18/h4-11H,12H2,1-3H3,(H,21,23).
What are the key properties of N-[[2-(4-methoxyphenyl)-4,6-dimethyl-3-pyridinyl]methyl]thiophene-2-carboxamide?
N-[[2-(4-methoxyphenyl)-4,6-dimethyl-3-pyridinyl]methyl]thiophene-2-carboxamide has a molecular weight of 352.46 g/mol, XLogP of 4.37, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(4-methoxyphenyl)-4,6-dimethyl-3-pyridinyl]methyl]thiophene-2-carboxamide is sourced from PubChem (CID 53148145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).