N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-6-(4-methoxyphenyl)-1-methylpyrrolo[3,2-c]pyridine-4-carboxamide

C24H24N4O3 — CID 134809638

IUPACN-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-6-(4-methoxyphenyl)-1-methylpyrrolo[3,2-c]pyridine-4-carboxamide
SMILESCOc1ccc(-c2cc3c(ccn3C)c(C(=O)NCc3c(C)cc(C)[nH]c3=O)n2)cc1
InChIInChI=1S/C24H24N4O3/c1-14-11-15(2)26-23(29)19(14)13-25-24(30)22-18-9-10-28(3)21(18)12-20(27-22)16-5-7-17(31-4)8-6-16/h5-12H,13H2,1-4H3,(H,25,30)(H,26,29)
InChIKeyWKVFXIRWENIJJR-UHFFFAOYSA-N
MW416.48 g/mol
LogP3.48
Rot. Bonds5

About N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-6-(4-methoxyphenyl)-1-methylpyrrolo[3,2-c]pyridine-4-carboxamide

N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-6-(4-methoxyphenyl)-1-methylpyrrolo[3,2-c]pyridine-4-carboxamide (PubChem CID 134809638) has the molecular formula C24H24N4O3 and a molecular weight of 416.48 g/mol. Its IUPAC name is N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-6-(4-methoxyphenyl)-1-methylpyrrolo[3,2-c]pyridine-4-carboxamide.

Molecular Properties

Compound NameN-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-6-(4-methoxyphenyl)-1-methylpyrrolo[3,2-c]pyridine-4-carboxamide
PubChem CID134809638
Molecular FormulaC24H24N4O3
Molecular Weight416.48 g/mol
Exact Mass416.18
IUPAC NameN-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-6-(4-methoxyphenyl)-1-methylpyrrolo[3,2-c]pyridine-4-carboxamide
SMILESCOc1ccc(-c2cc3c(ccn3C)c(C(=O)NCc3c(C)cc(C)[nH]c3=O)n2)cc1
InChIInChI=1S/C24H24N4O3/c1-14-11-15(2)26-23(29)19(14)13-25-24(30)22-18-9-10-28(3)21(18)12-20(27-22)16-5-7-17(31-4)8-6-16/h5-12H,13H2,1-4H3,(H,25,30)(H,26,29)
InChIKeyWKVFXIRWENIJJR-UHFFFAOYSA-N
XLogP3.48
TPSA89.01 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500416.48
LogP ≤ 53.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-6-(3-methoxyphenyl)-1-methylpyrrolo[3,2-c]pyridine-4-carboxamide
CID 134804940
6-(4-methoxyphenyl)-1-methyl-N-(pyridin-3-ylmethyl)pyrrolo[3,2-c]pyridine-4-carboxamide
CID 134807730
N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-6-(2-methoxy-3-pyridinyl)-1H-pyrrolo[3,2-c]pyridine-4-carboxamide
CID 134807222
N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-2-phenylacetamide
CID 71901607
3-amino-N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]pyrazine-2-carboxamide
CID 41416693
N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-4-[(2-methyl-1,3-thiazol-4-yl)methoxy]benzamide
CID 17479318
N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-6-oxo-1-propylpyridazine-3-carboxamide
CID 18119515
3-(aminomethyl)-4,6-dimethyl-1H-pyridin-2-one;N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-5-methoxy-1-methyl-3-propan-2-ylindole-7-carboxamide;5-methoxy-1-methyl-3-propan-2-ylindole-7-carboxylic acid;hydrochloride
CID 157453221
6-chloro-N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 56597425
5-cyclobutyloxy-N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-2-fluorobenzamide
CID 146352020
N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-6-[3-[2-hydroxy-3-(methylamino)propoxy]phenyl]-1-propan-2-ylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 85471901
N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-5-methoxy-2,3-dihydro-1H-indene-4-carboxamide
CID 166313224

Frequently Asked Questions

What is the IUPAC name of N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-6-(4-methoxyphenyl)-1-methylpyrrolo[3,2-c]pyridine-4-carboxamide?
The IUPAC name of N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-6-(4-methoxyphenyl)-1-methylpyrrolo[3,2-c]pyridine-4-carboxamide (CID 134809638) is N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-6-(4-methoxyphenyl)-1-methylpyrrolo[3,2-c]pyridine-4-carboxamide.
What is the SMILES notation for N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-6-(4-methoxyphenyl)-1-methylpyrrolo[3,2-c]pyridine-4-carboxamide?
The canonical SMILES for N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-6-(4-methoxyphenyl)-1-methylpyrrolo[3,2-c]pyridine-4-carboxamide is COc1ccc(-c2cc3c(ccn3C)c(C(=O)NCc3c(C)cc(C)[nH]c3=O)n2)cc1.
What is the InChIKey of N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-6-(4-methoxyphenyl)-1-methylpyrrolo[3,2-c]pyridine-4-carboxamide?
The InChIKey is WKVFXIRWENIJJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N4O3/c1-14-11-15(2)26-23(29)19(14)13-25-24(30)22-18-9-10-28(3)21(18)12-20(27-22)16-5-7-17(31-4)8-6-16/h5-12H,13H2,1-4H3,(H,25,30)(H,26,29).
What are the key properties of N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-6-(4-methoxyphenyl)-1-methylpyrrolo[3,2-c]pyridine-4-carboxamide?
N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-6-(4-methoxyphenyl)-1-methylpyrrolo[3,2-c]pyridine-4-carboxamide has a molecular weight of 416.48 g/mol, XLogP of 3.48, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-6-(4-methoxyphenyl)-1-methylpyrrolo[3,2-c]pyridine-4-carboxamide is sourced from PubChem (CID 134809638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).