N-(1H-indol-4-yl)-2-(5-methoxy-2-methyl-4-oxo-1-pyridinyl)acetamide

C17H17N3O3 — CID 110204502

IUPACN-(1H-indol-4-yl)-2-(5-methoxy-2-methyl-4-oxo-1-pyridinyl)acetamide
SMILESCOc1cn(CC(=O)Nc2cccc3[nH]ccc23)c(C)cc1=O
InChIInChI=1S/C17H17N3O3/c1-11-8-15(21)16(23-2)9-20(11)10-17(22)19-14-5-3-4-13-12(14)6-7-18-13/h3-9,18H,10H2,1-2H3,(H,19,22)
InChIKeyFCCALFZJVZTGJF-UHFFFAOYSA-N
MW311.34 g/mol
LogP2.29
Rot. Bonds4

About N-(1H-indol-4-yl)-2-(5-methoxy-2-methyl-4-oxo-1-pyridinyl)acetamide

N-(1H-indol-4-yl)-2-(5-methoxy-2-methyl-4-oxo-1-pyridinyl)acetamide (PubChem CID 110204502) has the molecular formula C17H17N3O3 and a molecular weight of 311.34 g/mol. Its IUPAC name is N-(1H-indol-4-yl)-2-(5-methoxy-2-methyl-4-oxo-1-pyridinyl)acetamide.

Molecular Properties

Compound NameN-(1H-indol-4-yl)-2-(5-methoxy-2-methyl-4-oxo-1-pyridinyl)acetamide
PubChem CID110204502
Molecular FormulaC17H17N3O3
Molecular Weight311.34 g/mol
Exact Mass311.13
IUPAC NameN-(1H-indol-4-yl)-2-(5-methoxy-2-methyl-4-oxo-1-pyridinyl)acetamide
SMILESCOc1cn(CC(=O)Nc2cccc3[nH]ccc23)c(C)cc1=O
InChIInChI=1S/C17H17N3O3/c1-11-8-15(21)16(23-2)9-20(11)10-17(22)19-14-5-3-4-13-12(14)6-7-18-13/h3-9,18H,10H2,1-2H3,(H,19,22)
InChIKeyFCCALFZJVZTGJF-UHFFFAOYSA-N
XLogP2.29
TPSA76.12 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.34
LogP ≤ 52.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(1H-indol-4-yl)-2-(5-methoxy-2-methyl-4-oxo-1-pyridinyl)acetamide?
The IUPAC name of N-(1H-indol-4-yl)-2-(5-methoxy-2-methyl-4-oxo-1-pyridinyl)acetamide (CID 110204502) is N-(1H-indol-4-yl)-2-(5-methoxy-2-methyl-4-oxo-1-pyridinyl)acetamide.
What is the SMILES notation for N-(1H-indol-4-yl)-2-(5-methoxy-2-methyl-4-oxo-1-pyridinyl)acetamide?
The canonical SMILES for N-(1H-indol-4-yl)-2-(5-methoxy-2-methyl-4-oxo-1-pyridinyl)acetamide is COc1cn(CC(=O)Nc2cccc3[nH]ccc23)c(C)cc1=O.
What is the InChIKey of N-(1H-indol-4-yl)-2-(5-methoxy-2-methyl-4-oxo-1-pyridinyl)acetamide?
The InChIKey is FCCALFZJVZTGJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3O3/c1-11-8-15(21)16(23-2)9-20(11)10-17(22)19-14-5-3-4-13-12(14)6-7-18-13/h3-9,18H,10H2,1-2H3,(H,19,22).
What are the key properties of N-(1H-indol-4-yl)-2-(5-methoxy-2-methyl-4-oxo-1-pyridinyl)acetamide?
N-(1H-indol-4-yl)-2-(5-methoxy-2-methyl-4-oxo-1-pyridinyl)acetamide has a molecular weight of 311.34 g/mol, XLogP of 2.29, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-indol-4-yl)-2-(5-methoxy-2-methyl-4-oxo-1-pyridinyl)acetamide is sourced from PubChem (CID 110204502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).