(6R)-6-(4-methoxyphenyl)-1,5,6,7-tetrahydroindazol-4-one

C14H14N2O2 — CID 7306559

IUPAC(6R)-6-(4-methoxyphenyl)-1,5,6,7-tetrahydroindazol-4-one
SMILESCOc1ccc([C@H]2CC(=O)c3cn[nH]c3C2)cc1
InChIInChI=1S/C14H14N2O2/c1-18-11-4-2-9(3-5-11)10-6-13-12(8-15-16-13)14(17)7-10/h2-5,8,10H,6-7H2,1H3,(H,15,16)/t10-/m1/s1
InChIKeyAFOHREMXXOQWDJ-SNVBAGLBSA-N
MW242.28 g/mol
LogP2.33
Rot. Bonds2

About (6R)-6-(4-methoxyphenyl)-1,5,6,7-tetrahydroindazol-4-one

(6R)-6-(4-methoxyphenyl)-1,5,6,7-tetrahydroindazol-4-one (PubChem CID 7306559) has the molecular formula C14H14N2O2 and a molecular weight of 242.28 g/mol. Its IUPAC name is (6R)-6-(4-methoxyphenyl)-1,5,6,7-tetrahydroindazol-4-one.

Molecular Properties

Compound Name(6R)-6-(4-methoxyphenyl)-1,5,6,7-tetrahydroindazol-4-one
PubChem CID7306559
Molecular FormulaC14H14N2O2
Molecular Weight242.28 g/mol
Exact Mass242.11
IUPAC Name(6R)-6-(4-methoxyphenyl)-1,5,6,7-tetrahydroindazol-4-one
SMILESCOc1ccc([C@H]2CC(=O)c3cn[nH]c3C2)cc1
InChIInChI=1S/C14H14N2O2/c1-18-11-4-2-9(3-5-11)10-6-13-12(8-15-16-13)14(17)7-10/h2-5,8,10H,6-7H2,1H3,(H,15,16)/t10-/m1/s1
InChIKeyAFOHREMXXOQWDJ-SNVBAGLBSA-N
XLogP2.33
TPSA54.98 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.28
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (6R)-6-(4-methoxyphenyl)-1,5,6,7-tetrahydroindazol-4-one 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

(6R)-6-phenyl-1,5,6,7-tetrahydroindazol-4-one
CID 7340088
(6S)-6-(2,4-dimethoxyphenyl)-1,5,6,7-tetrahydroindazol-4-one
CID 40713699
(6R)-6-(3-chlorophenyl)-1,5,6,7-tetrahydroindazol-4-one
CID 41386742
6-methyl-1,5,6,7-tetrahydroindazol-4-one
CID 17027693
(6R)-6-(2-methylphenyl)-1,5,6,7-tetrahydroindazol-4-one
CID 41386744
(6S)-1,6-bis(4-methoxyphenyl)-6,7-dihydro-5H-indazol-4-one
CID 26433714
N-[7-(4-methoxyphenyl)-5-oxo-7,8-dihydro-6H-quinazolin-2-yl]acetamide
CID 3139680
(6S)-6-(4-methoxyphenyl)-1-phenyl-6,7-dihydro-5H-indazol-4-one
CID 7447090
(9R)-3-amino-9-(4-methoxyphenyl)-2,8,9,10-tetrahydropyrimido[4,5-c]isoquinoline-1,7-dione
CID 135894999
(6S)-6-(4-methoxyphenyl)-2-methyl-6,7-dihydro-5H-[1,2,4]triazolo[5,1-b]quinazolin-8-one
CID 29108906
(7R)-2-(4-methoxyanilino)-7-(4-methylphenyl)-7,8-dihydro-6H-quinazolin-5-one
CID 1415093
(7R)-2-[(3S,5S)-3,5-dimethylpiperidin-1-yl]-7-(4-methoxyphenyl)-7,8-dihydro-6H-quinazolin-5-one
CID 98216835

Frequently Asked Questions

What is the IUPAC name of (6R)-6-(4-methoxyphenyl)-1,5,6,7-tetrahydroindazol-4-one?
The IUPAC name of (6R)-6-(4-methoxyphenyl)-1,5,6,7-tetrahydroindazol-4-one (CID 7306559) is (6R)-6-(4-methoxyphenyl)-1,5,6,7-tetrahydroindazol-4-one.
What is the SMILES notation for (6R)-6-(4-methoxyphenyl)-1,5,6,7-tetrahydroindazol-4-one?
The canonical SMILES for (6R)-6-(4-methoxyphenyl)-1,5,6,7-tetrahydroindazol-4-one is COc1ccc([C@H]2CC(=O)c3cn[nH]c3C2)cc1.
What is the InChIKey of (6R)-6-(4-methoxyphenyl)-1,5,6,7-tetrahydroindazol-4-one?
The InChIKey is AFOHREMXXOQWDJ-SNVBAGLBSA-N. The full InChI is InChI=1S/C14H14N2O2/c1-18-11-4-2-9(3-5-11)10-6-13-12(8-15-16-13)14(17)7-10/h2-5,8,10H,6-7H2,1H3,(H,15,16)/t10-/m1/s1.
What are the key properties of (6R)-6-(4-methoxyphenyl)-1,5,6,7-tetrahydroindazol-4-one?
(6R)-6-(4-methoxyphenyl)-1,5,6,7-tetrahydroindazol-4-one has a molecular weight of 242.28 g/mol, XLogP of 2.33, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (6R)-6-(4-methoxyphenyl)-1,5,6,7-tetrahydroindazol-4-one is sourced from PubChem (CID 7306559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).