N-benzyl-5-[4-(2-cyclopropylethoxy)-2-oxo-1-pyridinyl]-3-methylthiophene-2-carboxamide

C23H24N2O3S — CID 24985791

IUPACN-benzyl-5-[4-(2-cyclopropylethoxy)-2-oxo-1-pyridinyl]-3-methylthiophene-2-carboxamide
SMILESCc1cc(-n2ccc(OCCC3CC3)cc2=O)sc1C(=O)NCc1ccccc1
InChIInChI=1S/C23H24N2O3S/c1-16-13-21(29-22(16)23(27)24-15-18-5-3-2-4-6-18)25-11-9-19(14-20(25)26)28-12-10-17-7-8-17/h2-6,9,11,13-14,17H,7-8,10,12,15H2,1H3,(H,24,27)
InChIKeyVOEJMCOLGSDZDQ-UHFFFAOYSA-N
MW408.52 g/mol
LogP4.32
Rot. Bonds8

About N-benzyl-5-[4-(2-cyclopropylethoxy)-2-oxo-1-pyridinyl]-3-methylthiophene-2-carboxamide

N-benzyl-5-[4-(2-cyclopropylethoxy)-2-oxo-1-pyridinyl]-3-methylthiophene-2-carboxamide (PubChem CID 24985791) has the molecular formula C23H24N2O3S and a molecular weight of 408.52 g/mol. Its IUPAC name is N-benzyl-5-[4-(2-cyclopropylethoxy)-2-oxo-1-pyridinyl]-3-methylthiophene-2-carboxamide.

Molecular Properties

Compound NameN-benzyl-5-[4-(2-cyclopropylethoxy)-2-oxo-1-pyridinyl]-3-methylthiophene-2-carboxamide
PubChem CID24985791
Molecular FormulaC23H24N2O3S
Molecular Weight408.52 g/mol
Exact Mass408.15
IUPAC NameN-benzyl-5-[4-(2-cyclopropylethoxy)-2-oxo-1-pyridinyl]-3-methylthiophene-2-carboxamide
SMILESCc1cc(-n2ccc(OCCC3CC3)cc2=O)sc1C(=O)NCc1ccccc1
InChIInChI=1S/C23H24N2O3S/c1-16-13-21(29-22(16)23(27)24-15-18-5-3-2-4-6-18)25-11-9-19(14-20(25)26)28-12-10-17-7-8-17/h2-6,9,11,13-14,17H,7-8,10,12,15H2,1H3,(H,24,27)
InChIKeyVOEJMCOLGSDZDQ-UHFFFAOYSA-N
XLogP4.32
TPSA60.33 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500408.52
LogP ≤ 54.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-[4-methyl-5-(3-phenylpropanoyl)thiophen-2-yl]-4-(2-phenylethoxy)pyridin-2-one
CID 149317799
1-[4-methyl-5-(3-phenylpropanoyl)thiophen-2-yl]-4-phenylmethoxypyridin-2-one
CID 162219045
N-benzyl-4-methyl-2-[2-oxo-4-(2-phenylethyl)-1-pyridinyl]-1,3-thiazole-5-carboxamide
CID 24984128
N-benzyl-5-methyl-2-(2-oxo-4-phenylmethoxy-1-pyridinyl)-1H-imidazole-4-carboxamide
CID 24985616
5-(cyclopropanecarbonylamino)-N-[[4-(2-methoxyethoxy)phenyl]methyl]-3-methylthiophene-2-carboxamide
CID 86989867
N-benzyl-4-methyl-2-(2-oxo-6-phenylmethoxyquinolin-1-yl)-1,3-thiazole-5-carboxamide
CID 24985614
N-benzyl-3-methyl-5-[2-oxo-4-(2-phenylethoxy)-1H-pyridin-3-yl]thiophene-2-carboxamide
CID 68648682
N-[[3-(2-methoxyethoxy)phenyl]methyl]-4-methyl-2-phenyl-1,3-thiazole-5-carboxamide
CID 55804099
N-benzyl-4-(2-pyridin-4-yloxyethyl)piperidine-1-carboxamide
CID 53150970
N-benzyl-1,2-dimethyl-6-oxopyridine-4-carboxamide
CID 20668750
N-[2-(benzylcarbamoyl)phenyl]-5-(cyclopropanecarbonylamino)-3-methylthiophene-2-carboxamide
CID 24676616
N-[(4-methoxyphenyl)methyl]-1-[(3-phenylmethoxyphenyl)methyl]piperidine-4-carboxamide
CID 4551423

Frequently Asked Questions

What is the IUPAC name of N-benzyl-5-[4-(2-cyclopropylethoxy)-2-oxo-1-pyridinyl]-3-methylthiophene-2-carboxamide?
The IUPAC name of N-benzyl-5-[4-(2-cyclopropylethoxy)-2-oxo-1-pyridinyl]-3-methylthiophene-2-carboxamide (CID 24985791) is N-benzyl-5-[4-(2-cyclopropylethoxy)-2-oxo-1-pyridinyl]-3-methylthiophene-2-carboxamide.
What is the SMILES notation for N-benzyl-5-[4-(2-cyclopropylethoxy)-2-oxo-1-pyridinyl]-3-methylthiophene-2-carboxamide?
The canonical SMILES for N-benzyl-5-[4-(2-cyclopropylethoxy)-2-oxo-1-pyridinyl]-3-methylthiophene-2-carboxamide is Cc1cc(-n2ccc(OCCC3CC3)cc2=O)sc1C(=O)NCc1ccccc1.
What is the InChIKey of N-benzyl-5-[4-(2-cyclopropylethoxy)-2-oxo-1-pyridinyl]-3-methylthiophene-2-carboxamide?
The InChIKey is VOEJMCOLGSDZDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2O3S/c1-16-13-21(29-22(16)23(27)24-15-18-5-3-2-4-6-18)25-11-9-19(14-20(25)26)28-12-10-17-7-8-17/h2-6,9,11,13-14,17H,7-8,10,12,15H2,1H3,(H,24,27).
What are the key properties of N-benzyl-5-[4-(2-cyclopropylethoxy)-2-oxo-1-pyridinyl]-3-methylthiophene-2-carboxamide?
N-benzyl-5-[4-(2-cyclopropylethoxy)-2-oxo-1-pyridinyl]-3-methylthiophene-2-carboxamide has a molecular weight of 408.52 g/mol, XLogP of 4.32, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-5-[4-(2-cyclopropylethoxy)-2-oxo-1-pyridinyl]-3-methylthiophene-2-carboxamide is sourced from PubChem (CID 24985791), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).