6-(4-methoxyphenyl)-1-methyl-N-(pyridin-3-ylmethyl)pyrrolo[3,2-c]pyridine-4-carboxamide

C22H20N4O2 — CID 134807730

IUPAC6-(4-methoxyphenyl)-1-methyl-N-(pyridin-3-ylmethyl)pyrrolo[3,2-c]pyridine-4-carboxamide
SMILESCOc1ccc(-c2cc3c(ccn3C)c(C(=O)NCc3cccnc3)n2)cc1
InChIInChI=1S/C22H20N4O2/c1-26-11-9-18-20(26)12-19(16-5-7-17(28-2)8-6-16)25-21(18)22(27)24-14-15-4-3-10-23-13-15/h3-13H,14H2,1-2H3,(H,24,27)
InChIKeyNUJAMTWFXWUCNH-UHFFFAOYSA-N
MW372.43 g/mol
LogP3.57
Rot. Bonds5

About 6-(4-methoxyphenyl)-1-methyl-N-(pyridin-3-ylmethyl)pyrrolo[3,2-c]pyridine-4-carboxamide

6-(4-methoxyphenyl)-1-methyl-N-(pyridin-3-ylmethyl)pyrrolo[3,2-c]pyridine-4-carboxamide (PubChem CID 134807730) has the molecular formula C22H20N4O2 and a molecular weight of 372.43 g/mol. Its IUPAC name is 6-(4-methoxyphenyl)-1-methyl-N-(pyridin-3-ylmethyl)pyrrolo[3,2-c]pyridine-4-carboxamide.

Molecular Properties

Compound Name6-(4-methoxyphenyl)-1-methyl-N-(pyridin-3-ylmethyl)pyrrolo[3,2-c]pyridine-4-carboxamide
PubChem CID134807730
Molecular FormulaC22H20N4O2
Molecular Weight372.43 g/mol
Exact Mass372.16
IUPAC Name6-(4-methoxyphenyl)-1-methyl-N-(pyridin-3-ylmethyl)pyrrolo[3,2-c]pyridine-4-carboxamide
SMILESCOc1ccc(-c2cc3c(ccn3C)c(C(=O)NCc3cccnc3)n2)cc1
InChIInChI=1S/C22H20N4O2/c1-26-11-9-18-20(26)12-19(16-5-7-17(28-2)8-6-16)25-21(18)22(27)24-14-15-4-3-10-23-13-15/h3-13H,14H2,1-2H3,(H,24,27)
InChIKeyNUJAMTWFXWUCNH-UHFFFAOYSA-N
XLogP3.57
TPSA69.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.43
LogP ≤ 53.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-(3,4-dimethoxyphenyl)-1-methyl-N-(pyridin-3-ylmethyl)pyrrolo[3,2-c]pyridine-4-carboxamide
CID 134807721
6-[4-(hydroxymethyl)phenyl]-1-methyl-N-(pyridin-3-ylmethyl)pyrrolo[3,2-c]pyridine-4-carboxamide
CID 134811001
6-(3-hydroxyphenyl)-1-methyl-N-(pyridin-3-ylmethyl)pyrrolo[3,2-c]pyridine-4-carboxamide
CID 134806937
N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-6-(4-methoxyphenyl)-1-methylpyrrolo[3,2-c]pyridine-4-carboxamide
CID 134809638
3-(4-methoxyphenyl)-N-(pyridin-3-ylmethyl)imidazo[1,2-a]pyridine-2-carboxamide
CID 87051619
2-(4-methoxyphenyl)-6-propan-2-yl-N-(pyridin-3-ylmethyl)quinoline-4-carboxamide
CID 3443765
6-(1-methylindol-5-yl)-N-(pyridin-3-ylmethyl)pyridine-2-carboxamide
CID 117093745
2-[4-(4-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-N-(pyridin-3-ylmethyl)acetamide
CID 993314
N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-6-(3-methoxyphenyl)-1-methylpyrrolo[3,2-c]pyridine-4-carboxamide
CID 134804940
2,3-bis(4-methoxyphenyl)-N-(pyridin-3-ylmethyl)quinoxaline-6-carboxamide
CID 5073153
1-acetyl-5-methoxy-N-(pyridin-3-ylmethyl)indole-3-carboxamide
CID 113212725
3-(3-methoxyphenyl)-1-(4-methoxyphenyl)-N-(pyridin-3-ylmethyl)pyrazole-5-carboxamide
CID 4282121

Frequently Asked Questions

What is the IUPAC name of 6-(4-methoxyphenyl)-1-methyl-N-(pyridin-3-ylmethyl)pyrrolo[3,2-c]pyridine-4-carboxamide?
The IUPAC name of 6-(4-methoxyphenyl)-1-methyl-N-(pyridin-3-ylmethyl)pyrrolo[3,2-c]pyridine-4-carboxamide (CID 134807730) is 6-(4-methoxyphenyl)-1-methyl-N-(pyridin-3-ylmethyl)pyrrolo[3,2-c]pyridine-4-carboxamide.
What is the SMILES notation for 6-(4-methoxyphenyl)-1-methyl-N-(pyridin-3-ylmethyl)pyrrolo[3,2-c]pyridine-4-carboxamide?
The canonical SMILES for 6-(4-methoxyphenyl)-1-methyl-N-(pyridin-3-ylmethyl)pyrrolo[3,2-c]pyridine-4-carboxamide is COc1ccc(-c2cc3c(ccn3C)c(C(=O)NCc3cccnc3)n2)cc1.
What is the InChIKey of 6-(4-methoxyphenyl)-1-methyl-N-(pyridin-3-ylmethyl)pyrrolo[3,2-c]pyridine-4-carboxamide?
The InChIKey is NUJAMTWFXWUCNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20N4O2/c1-26-11-9-18-20(26)12-19(16-5-7-17(28-2)8-6-16)25-21(18)22(27)24-14-15-4-3-10-23-13-15/h3-13H,14H2,1-2H3,(H,24,27).
What are the key properties of 6-(4-methoxyphenyl)-1-methyl-N-(pyridin-3-ylmethyl)pyrrolo[3,2-c]pyridine-4-carboxamide?
6-(4-methoxyphenyl)-1-methyl-N-(pyridin-3-ylmethyl)pyrrolo[3,2-c]pyridine-4-carboxamide has a molecular weight of 372.43 g/mol, XLogP of 3.57, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-methoxyphenyl)-1-methyl-N-(pyridin-3-ylmethyl)pyrrolo[3,2-c]pyridine-4-carboxamide is sourced from PubChem (CID 134807730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).