7-hydroxy-4-methyl-N-naphthalen-1-yl-2-oxoquinoline-1-carboxamide

C21H16N2O3 — CID 175672938

IUPAC7-hydroxy-4-methyl-N-naphthalen-1-yl-2-oxoquinoline-1-carboxamide
SMILESCc1cc(=O)n(C(=O)Nc2cccc3ccccc23)c2cc(O)ccc12
InChIInChI=1S/C21H16N2O3/c1-13-11-20(25)23(19-12-15(24)9-10-16(13)19)21(26)22-18-8-4-6-14-5-2-3-7-17(14)18/h2-12,24H,1H3,(H,22,26)
InChIKeyGPEWQHHEBQLQHU-UHFFFAOYSA-N
MW344.37 g/mol
LogP4.25
Rot. Bonds1

About 7-hydroxy-4-methyl-N-naphthalen-1-yl-2-oxoquinoline-1-carboxamide

7-hydroxy-4-methyl-N-naphthalen-1-yl-2-oxoquinoline-1-carboxamide (PubChem CID 175672938) has the molecular formula C21H16N2O3 and a molecular weight of 344.37 g/mol. Its IUPAC name is 7-hydroxy-4-methyl-N-naphthalen-1-yl-2-oxoquinoline-1-carboxamide.

Molecular Properties

Compound Name7-hydroxy-4-methyl-N-naphthalen-1-yl-2-oxoquinoline-1-carboxamide
PubChem CID175672938
Molecular FormulaC21H16N2O3
Molecular Weight344.37 g/mol
Exact Mass344.12
IUPAC Name7-hydroxy-4-methyl-N-naphthalen-1-yl-2-oxoquinoline-1-carboxamide
SMILESCc1cc(=O)n(C(=O)Nc2cccc3ccccc23)c2cc(O)ccc12
InChIInChI=1S/C21H16N2O3/c1-13-11-20(25)23(19-12-15(24)9-10-16(13)19)21(26)22-18-8-4-6-14-5-2-3-7-17(14)18/h2-12,24H,1H3,(H,22,26)
InChIKeyGPEWQHHEBQLQHU-UHFFFAOYSA-N
XLogP4.25
TPSA71.33 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.37
LogP ≤ 54.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 7-hydroxy-4-methyl-N-naphthalen-1-yl-2-oxoquinoline-1-carboxamide?
The IUPAC name of 7-hydroxy-4-methyl-N-naphthalen-1-yl-2-oxoquinoline-1-carboxamide (CID 175672938) is 7-hydroxy-4-methyl-N-naphthalen-1-yl-2-oxoquinoline-1-carboxamide.
What is the SMILES notation for 7-hydroxy-4-methyl-N-naphthalen-1-yl-2-oxoquinoline-1-carboxamide?
The canonical SMILES for 7-hydroxy-4-methyl-N-naphthalen-1-yl-2-oxoquinoline-1-carboxamide is Cc1cc(=O)n(C(=O)Nc2cccc3ccccc23)c2cc(O)ccc12.
What is the InChIKey of 7-hydroxy-4-methyl-N-naphthalen-1-yl-2-oxoquinoline-1-carboxamide?
The InChIKey is GPEWQHHEBQLQHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H16N2O3/c1-13-11-20(25)23(19-12-15(24)9-10-16(13)19)21(26)22-18-8-4-6-14-5-2-3-7-17(14)18/h2-12,24H,1H3,(H,22,26).
What are the key properties of 7-hydroxy-4-methyl-N-naphthalen-1-yl-2-oxoquinoline-1-carboxamide?
7-hydroxy-4-methyl-N-naphthalen-1-yl-2-oxoquinoline-1-carboxamide has a molecular weight of 344.37 g/mol, XLogP of 4.25, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-hydroxy-4-methyl-N-naphthalen-1-yl-2-oxoquinoline-1-carboxamide is sourced from PubChem (CID 175672938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).