4-oxo-1-quinolin-2-yl-6,7-dihydro-5H-indazole-3-carboxamide

C17H14N4O2 — CID 110458519

IUPAC4-oxo-1-quinolin-2-yl-6,7-dihydro-5H-indazole-3-carboxamide
SMILESNC(=O)c1nn(-c2ccc3ccccc3n2)c2c1C(=O)CCC2
InChIInChI=1S/C17H14N4O2/c18-17(23)16-15-12(6-3-7-13(15)22)21(20-16)14-9-8-10-4-1-2-5-11(10)19-14/h1-2,4-5,8-9H,3,6-7H2,(H2,18,23)
InChIKeyRQHDOHQHQSFBJM-UHFFFAOYSA-N
MW306.32 g/mol
LogP2.04
Rot. Bonds2

About 4-oxo-1-quinolin-2-yl-6,7-dihydro-5H-indazole-3-carboxamide

4-oxo-1-quinolin-2-yl-6,7-dihydro-5H-indazole-3-carboxamide (PubChem CID 110458519) has the molecular formula C17H14N4O2 and a molecular weight of 306.32 g/mol. Its IUPAC name is 4-oxo-1-quinolin-2-yl-6,7-dihydro-5H-indazole-3-carboxamide.

Molecular Properties

Compound Name4-oxo-1-quinolin-2-yl-6,7-dihydro-5H-indazole-3-carboxamide
PubChem CID110458519
Molecular FormulaC17H14N4O2
Molecular Weight306.32 g/mol
Exact Mass306.11
IUPAC Name4-oxo-1-quinolin-2-yl-6,7-dihydro-5H-indazole-3-carboxamide
SMILESNC(=O)c1nn(-c2ccc3ccccc3n2)c2c1C(=O)CCC2
InChIInChI=1S/C17H14N4O2/c18-17(23)16-15-12(6-3-7-13(15)22)21(20-16)14-9-8-10-4-1-2-5-11(10)19-14/h1-2,4-5,8-9H,3,6-7H2,(H2,18,23)
InChIKeyRQHDOHQHQSFBJM-UHFFFAOYSA-N
XLogP2.04
TPSA90.87 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.32
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 4-oxo-1-quinolin-2-yl-6,7-dihydro-5H-indazole-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[4-(3-carbamoyl-4-oxo-6,7-dihydro-5H-indazol-1-yl)phenyl]acetic acid
CID 110458513
1-(2,5-difluorophenyl)-4-oxo-6,7-dihydro-5H-indazole-3-carboxamide
CID 82591104
5-amino-4-methyl-1-quinolin-2-ylpyrazole-3-carboxylic acid
CID 82590054
4-oxo-1-[[4-(trifluoromethyl)phenyl]methyl]-6,7-dihydro-5H-indazole-3-carboxamide
CID 110458508
methyl 4-oxo-1-phenyl-5,6,7,8-tetrahydrocyclohepta[c]pyrazole-3-carboxylate
CID 56589821
quinoline-2-carboxamide;hydrobromide
CID 141009871
2-(3-cyclohexyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-1-yl)quinoline
CID 110459045
3-cyclopropyl-1-pyridin-2-yl-6,7-dihydro-5H-indazol-4-one
CID 22732696
[4-carbamoyl-6-methyl-2-[(1-quinolin-2-ylpiperidin-4-yl)methyl]pyrimidin-5-yl] acetate
CID 123173461
3-methyl-2-quinolin-2-ylsulfanylcyclohex-2-en-1-one
CID 101184028
quinoline-2-carboxamide;quinoxaline
CID 159476975
4-quinolin-2-ylmorpholine-2-carboxamide
CID 133278543

Frequently Asked Questions

What is the IUPAC name of 4-oxo-1-quinolin-2-yl-6,7-dihydro-5H-indazole-3-carboxamide?
The IUPAC name of 4-oxo-1-quinolin-2-yl-6,7-dihydro-5H-indazole-3-carboxamide (CID 110458519) is 4-oxo-1-quinolin-2-yl-6,7-dihydro-5H-indazole-3-carboxamide.
What is the SMILES notation for 4-oxo-1-quinolin-2-yl-6,7-dihydro-5H-indazole-3-carboxamide?
The canonical SMILES for 4-oxo-1-quinolin-2-yl-6,7-dihydro-5H-indazole-3-carboxamide is NC(=O)c1nn(-c2ccc3ccccc3n2)c2c1C(=O)CCC2.
What is the InChIKey of 4-oxo-1-quinolin-2-yl-6,7-dihydro-5H-indazole-3-carboxamide?
The InChIKey is RQHDOHQHQSFBJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N4O2/c18-17(23)16-15-12(6-3-7-13(15)22)21(20-16)14-9-8-10-4-1-2-5-11(10)19-14/h1-2,4-5,8-9H,3,6-7H2,(H2,18,23).
What are the key properties of 4-oxo-1-quinolin-2-yl-6,7-dihydro-5H-indazole-3-carboxamide?
4-oxo-1-quinolin-2-yl-6,7-dihydro-5H-indazole-3-carboxamide has a molecular weight of 306.32 g/mol, XLogP of 2.04, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-oxo-1-quinolin-2-yl-6,7-dihydro-5H-indazole-3-carboxamide is sourced from PubChem (CID 110458519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).