N-[(1-methyl-2-oxo-3,4-dihydroquinolin-4-yl)methyl]-1H-indazole-3-carboxamide

C19H18N4O2 — CID 77092972

IUPACN-[(1-methyl-2-oxo-3,4-dihydroquinolin-4-yl)methyl]-1H-indazole-3-carboxamide
SMILESCN1C(=O)CC(CNC(=O)c2n[nH]c3ccccc23)c2ccccc21
InChIInChI=1S/C19H18N4O2/c1-23-16-9-5-3-6-13(16)12(10-17(23)24)11-20-19(25)18-14-7-2-4-8-15(14)21-22-18/h2-9,12H,10-11H2,1H3,(H,20,25)(H,21,22)
InChIKeyJUZUFSDJLKBSNE-UHFFFAOYSA-N
MW334.38 g/mol
LogP2.44
Rot. Bonds3

About N-[(1-methyl-2-oxo-3,4-dihydroquinolin-4-yl)methyl]-1H-indazole-3-carboxamide

N-[(1-methyl-2-oxo-3,4-dihydroquinolin-4-yl)methyl]-1H-indazole-3-carboxamide (PubChem CID 77092972) has the molecular formula C19H18N4O2 and a molecular weight of 334.38 g/mol. Its IUPAC name is N-[(1-methyl-2-oxo-3,4-dihydroquinolin-4-yl)methyl]-1H-indazole-3-carboxamide.

Molecular Properties

Compound NameN-[(1-methyl-2-oxo-3,4-dihydroquinolin-4-yl)methyl]-1H-indazole-3-carboxamide
PubChem CID77092972
Molecular FormulaC19H18N4O2
Molecular Weight334.38 g/mol
Exact Mass334.14
IUPAC NameN-[(1-methyl-2-oxo-3,4-dihydroquinolin-4-yl)methyl]-1H-indazole-3-carboxamide
SMILESCN1C(=O)CC(CNC(=O)c2n[nH]c3ccccc23)c2ccccc21
InChIInChI=1S/C19H18N4O2/c1-23-16-9-5-3-6-13(16)12(10-17(23)24)11-20-19(25)18-14-7-2-4-8-15(14)21-22-18/h2-9,12H,10-11H2,1H3,(H,20,25)(H,21,22)
InChIKeyJUZUFSDJLKBSNE-UHFFFAOYSA-N
XLogP2.44
TPSA78.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.38
LogP ≤ 52.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(1-methyl-2-oxo-3,4-dihydroquinolin-4-yl)methyl]-1H-indazole-3-carboxamide?
The IUPAC name of N-[(1-methyl-2-oxo-3,4-dihydroquinolin-4-yl)methyl]-1H-indazole-3-carboxamide (CID 77092972) is N-[(1-methyl-2-oxo-3,4-dihydroquinolin-4-yl)methyl]-1H-indazole-3-carboxamide.
What is the SMILES notation for N-[(1-methyl-2-oxo-3,4-dihydroquinolin-4-yl)methyl]-1H-indazole-3-carboxamide?
The canonical SMILES for N-[(1-methyl-2-oxo-3,4-dihydroquinolin-4-yl)methyl]-1H-indazole-3-carboxamide is CN1C(=O)CC(CNC(=O)c2n[nH]c3ccccc23)c2ccccc21.
What is the InChIKey of N-[(1-methyl-2-oxo-3,4-dihydroquinolin-4-yl)methyl]-1H-indazole-3-carboxamide?
The InChIKey is JUZUFSDJLKBSNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N4O2/c1-23-16-9-5-3-6-13(16)12(10-17(23)24)11-20-19(25)18-14-7-2-4-8-15(14)21-22-18/h2-9,12H,10-11H2,1H3,(H,20,25)(H,21,22).
What are the key properties of N-[(1-methyl-2-oxo-3,4-dihydroquinolin-4-yl)methyl]-1H-indazole-3-carboxamide?
N-[(1-methyl-2-oxo-3,4-dihydroquinolin-4-yl)methyl]-1H-indazole-3-carboxamide has a molecular weight of 334.38 g/mol, XLogP of 2.44, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-methyl-2-oxo-3,4-dihydroquinolin-4-yl)methyl]-1H-indazole-3-carboxamide is sourced from PubChem (CID 77092972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).