N-(1H-indol-5-yl)-5-methoxy-1-methyl-4-oxopyridine-2-carboxamide

C16H15N3O3 — CID 51053405

IUPACN-(1H-indol-5-yl)-5-methoxy-1-methyl-4-oxopyridine-2-carboxamide
SMILESCOc1cn(C)c(C(=O)Nc2ccc3[nH]ccc3c2)cc1=O
InChIInChI=1S/C16H15N3O3/c1-19-9-15(22-2)14(20)8-13(19)16(21)18-11-3-4-12-10(7-11)5-6-17-12/h3-9,17H,1-2H3,(H,18,21)
InChIKeyBNPCCDLEQNIZCX-UHFFFAOYSA-N
MW297.31 g/mol
LogP2.13
Rot. Bonds3

About N-(1H-indol-5-yl)-5-methoxy-1-methyl-4-oxopyridine-2-carboxamide

N-(1H-indol-5-yl)-5-methoxy-1-methyl-4-oxopyridine-2-carboxamide (PubChem CID 51053405) has the molecular formula C16H15N3O3 and a molecular weight of 297.31 g/mol. Its IUPAC name is N-(1H-indol-5-yl)-5-methoxy-1-methyl-4-oxopyridine-2-carboxamide.

Molecular Properties

Compound NameN-(1H-indol-5-yl)-5-methoxy-1-methyl-4-oxopyridine-2-carboxamide
PubChem CID51053405
Molecular FormulaC16H15N3O3
Molecular Weight297.31 g/mol
Exact Mass297.11
IUPAC NameN-(1H-indol-5-yl)-5-methoxy-1-methyl-4-oxopyridine-2-carboxamide
SMILESCOc1cn(C)c(C(=O)Nc2ccc3[nH]ccc3c2)cc1=O
InChIInChI=1S/C16H15N3O3/c1-19-9-15(22-2)14(20)8-13(19)16(21)18-11-3-4-12-10(7-11)5-6-17-12/h3-9,17H,1-2H3,(H,18,21)
InChIKeyBNPCCDLEQNIZCX-UHFFFAOYSA-N
XLogP2.13
TPSA76.12 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.31
LogP ≤ 52.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(1H-indol-5-yl)-5-methoxy-1-methyl-4-oxopyridine-2-carboxamide?
The IUPAC name of N-(1H-indol-5-yl)-5-methoxy-1-methyl-4-oxopyridine-2-carboxamide (CID 51053405) is N-(1H-indol-5-yl)-5-methoxy-1-methyl-4-oxopyridine-2-carboxamide.
What is the SMILES notation for N-(1H-indol-5-yl)-5-methoxy-1-methyl-4-oxopyridine-2-carboxamide?
The canonical SMILES for N-(1H-indol-5-yl)-5-methoxy-1-methyl-4-oxopyridine-2-carboxamide is COc1cn(C)c(C(=O)Nc2ccc3[nH]ccc3c2)cc1=O.
What is the InChIKey of N-(1H-indol-5-yl)-5-methoxy-1-methyl-4-oxopyridine-2-carboxamide?
The InChIKey is BNPCCDLEQNIZCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O3/c1-19-9-15(22-2)14(20)8-13(19)16(21)18-11-3-4-12-10(7-11)5-6-17-12/h3-9,17H,1-2H3,(H,18,21).
What are the key properties of N-(1H-indol-5-yl)-5-methoxy-1-methyl-4-oxopyridine-2-carboxamide?
N-(1H-indol-5-yl)-5-methoxy-1-methyl-4-oxopyridine-2-carboxamide has a molecular weight of 297.31 g/mol, XLogP of 2.13, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-indol-5-yl)-5-methoxy-1-methyl-4-oxopyridine-2-carboxamide is sourced from PubChem (CID 51053405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).