4-hydroxy-5-methyl-2-oxo-N-phenylpyrano[3,2-b]indole-3-carboxamide

C19H14N2O4 — CID 54696259

IUPAC4-hydroxy-5-methyl-2-oxo-N-phenylpyrano[3,2-b]indole-3-carboxamide
SMILESCn1c2ccccc2c2oc(=O)c(C(=O)Nc3ccccc3)c(O)c21
InChIInChI=1S/C19H14N2O4/c1-21-13-10-6-5-9-12(13)17-15(21)16(22)14(19(24)25-17)18(23)20-11-7-3-2-4-8-11/h2-10,22H,1H3,(H,20,23)
InChIKeyUMABCTISJXVHJY-UHFFFAOYSA-N
MW334.33 g/mol
LogP3.24
Rot. Bonds2

About 4-hydroxy-5-methyl-2-oxo-N-phenylpyrano[3,2-b]indole-3-carboxamide

4-hydroxy-5-methyl-2-oxo-N-phenylpyrano[3,2-b]indole-3-carboxamide (PubChem CID 54696259) has the molecular formula C19H14N2O4 and a molecular weight of 334.33 g/mol. Its IUPAC name is 4-hydroxy-5-methyl-2-oxo-N-phenylpyrano[3,2-b]indole-3-carboxamide.

Molecular Properties

Compound Name4-hydroxy-5-methyl-2-oxo-N-phenylpyrano[3,2-b]indole-3-carboxamide
PubChem CID54696259
Molecular FormulaC19H14N2O4
Molecular Weight334.33 g/mol
Exact Mass334.10
IUPAC Name4-hydroxy-5-methyl-2-oxo-N-phenylpyrano[3,2-b]indole-3-carboxamide
SMILESCn1c2ccccc2c2oc(=O)c(C(=O)Nc3ccccc3)c(O)c21
InChIInChI=1S/C19H14N2O4/c1-21-13-10-6-5-9-12(13)17-15(21)16(22)14(19(24)25-17)18(23)20-11-7-3-2-4-8-11/h2-10,22H,1H3,(H,20,23)
InChIKeyUMABCTISJXVHJY-UHFFFAOYSA-N
XLogP3.24
TPSA84.47 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.33
LogP ≤ 53.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-hydroxy-1-methyl-2-oxo-N-phenylquinoline-3-carboxamide
CID 54676449
8-fluoro-4-hydroxy-2-oxo-N-phenylchromene-3-carboxamide
CID 54733251
5-acetyl-2,4-dihydroxy-6-oxo-N-phenylpyran-3-carboxamide
CID 136610051
4-hydroxy-3,6-dimethylpyrano[3,2-c]quinoline-2,5-dione
CID 110273333
6-chloro-4-hydroxy-1-methyl-2-oxo-N-phenylquinoline-3-carboxamide
CID 54717880
2-methyl-5-oxo-N,3-diphenyl-1,2-oxazole-4-carboxamide
CID 110681206
3-bromo-4-hydroxy-6-methylpyrano[3,2-c]quinoline-2,5-dione
CID 54718586
N-(4-chlorophenyl)-4-hydroxy-2-oxochromene-3-carboxamide
CID 54698718
1-methyl-2-oxo-N-[4-(phenylcarbamoylamino)phenyl]quinoline-4-carboxamide
CID 55909182
[4-[(4-hydroxy-1-methyl-2-oxoquinoline-3-carbonyl)amino]phenyl] 2,2-dimethylpropanoate
CID 54717945
4-hydroxy-1-methyl-2-oxo-N-(4-propoxyphenyl)quinoline-3-carboxamide
CID 54677084
2,3,4,5,6-pentamethyl-N-phenylbenzamide
CID 60629319

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-5-methyl-2-oxo-N-phenylpyrano[3,2-b]indole-3-carboxamide?
The IUPAC name of 4-hydroxy-5-methyl-2-oxo-N-phenylpyrano[3,2-b]indole-3-carboxamide (CID 54696259) is 4-hydroxy-5-methyl-2-oxo-N-phenylpyrano[3,2-b]indole-3-carboxamide.
What is the SMILES notation for 4-hydroxy-5-methyl-2-oxo-N-phenylpyrano[3,2-b]indole-3-carboxamide?
The canonical SMILES for 4-hydroxy-5-methyl-2-oxo-N-phenylpyrano[3,2-b]indole-3-carboxamide is Cn1c2ccccc2c2oc(=O)c(C(=O)Nc3ccccc3)c(O)c21.
What is the InChIKey of 4-hydroxy-5-methyl-2-oxo-N-phenylpyrano[3,2-b]indole-3-carboxamide?
The InChIKey is UMABCTISJXVHJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14N2O4/c1-21-13-10-6-5-9-12(13)17-15(21)16(22)14(19(24)25-17)18(23)20-11-7-3-2-4-8-11/h2-10,22H,1H3,(H,20,23).
What are the key properties of 4-hydroxy-5-methyl-2-oxo-N-phenylpyrano[3,2-b]indole-3-carboxamide?
4-hydroxy-5-methyl-2-oxo-N-phenylpyrano[3,2-b]indole-3-carboxamide has a molecular weight of 334.33 g/mol, XLogP of 3.24, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-5-methyl-2-oxo-N-phenylpyrano[3,2-b]indole-3-carboxamide is sourced from PubChem (CID 54696259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).