3-(3-methoxyphenyl)indeno[1,2-c]pyridazin-5-one

C18H12N2O2 — CID 10469356

IUPAC3-(3-methoxyphenyl)indeno[1,2-c]pyridazin-5-one
SMILESCOc1cccc(-c2cc3c(nn2)-c2ccccc2C3=O)c1
InChIInChI=1S/C18H12N2O2/c1-22-12-6-4-5-11(9-12)16-10-15-17(20-19-16)13-7-2-3-8-14(13)18(15)21/h2-10H,1H3
InChIKeyVMMVYTINFCBHDT-UHFFFAOYSA-N
MW288.31 g/mol
LogP3.36
Rot. Bonds2

About 3-(3-methoxyphenyl)indeno[1,2-c]pyridazin-5-one

3-(3-methoxyphenyl)indeno[1,2-c]pyridazin-5-one (PubChem CID 10469356) has the molecular formula C18H12N2O2 and a molecular weight of 288.31 g/mol. Its IUPAC name is 3-(3-methoxyphenyl)indeno[1,2-c]pyridazin-5-one.

Molecular Properties

Compound Name3-(3-methoxyphenyl)indeno[1,2-c]pyridazin-5-one
PubChem CID10469356
Molecular FormulaC18H12N2O2
Molecular Weight288.31 g/mol
Exact Mass288.09
IUPAC Name3-(3-methoxyphenyl)indeno[1,2-c]pyridazin-5-one
SMILESCOc1cccc(-c2cc3c(nn2)-c2ccccc2C3=O)c1
InChIInChI=1S/C18H12N2O2/c1-22-12-6-4-5-11(9-12)16-10-15-17(20-19-16)13-7-2-3-8-14(13)18(15)21/h2-10H,1H3
InChIKeyVMMVYTINFCBHDT-UHFFFAOYSA-N
XLogP3.36
TPSA52.08 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.31
LogP ≤ 53.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'keto_phenone_A(11)', 'substructure': 'N/A'}

Analyze 3-(3-methoxyphenyl)indeno[1,2-c]pyridazin-5-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

3-(4-methylphenyl)indeno[1,2-c]pyridazin-5-one
CID 2767330
3-(3-methoxyphenyl)-7-methyl-7,8-dihydro-6H-cinnolin-5-one
CID 23086704
3-methoxy-6-(3-methoxyphenyl)pyridazin-4-amine
CID 117127015
3-(3-methoxyphenyl)-6-[5-(3-methoxyphenyl)-6-methyl-2-pyridinyl]-2-methylpyridine
CID 101485058
4-bromo-3-chloro-6-(3-methoxyphenyl)pyridazine
CID 117107007
10-(3-methoxyphenyl)-11,12,14,16-tetrazatetracyclo[7.7.0.02,7.011,15]hexadeca-1(16),2,4,6,9,12,14-heptaen-8-one
CID 2034808
2-[2-(3-methoxyphenyl)phenyl]phenol
CID 135057832
2,3,5,6-tetrakis(3-methoxyphenyl)pyrazine
CID 132941107
4-bromo-N-[2-(3-methoxyphenyl)phenyl]benzenesulfonamide
CID 135086781
azane;1-methoxy-3-(3-methoxyphenyl)benzene
CID 174719266
1-methoxy-3-(3-methoxyphenyl)benzene;sulfane
CID 175169762
2-[2-(3-methoxyphenyl)phenyl]acetic acid
CID 2759556

Frequently Asked Questions

What is the IUPAC name of 3-(3-methoxyphenyl)indeno[1,2-c]pyridazin-5-one?
The IUPAC name of 3-(3-methoxyphenyl)indeno[1,2-c]pyridazin-5-one (CID 10469356) is 3-(3-methoxyphenyl)indeno[1,2-c]pyridazin-5-one.
What is the SMILES notation for 3-(3-methoxyphenyl)indeno[1,2-c]pyridazin-5-one?
The canonical SMILES for 3-(3-methoxyphenyl)indeno[1,2-c]pyridazin-5-one is COc1cccc(-c2cc3c(nn2)-c2ccccc2C3=O)c1.
What is the InChIKey of 3-(3-methoxyphenyl)indeno[1,2-c]pyridazin-5-one?
The InChIKey is VMMVYTINFCBHDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H12N2O2/c1-22-12-6-4-5-11(9-12)16-10-15-17(20-19-16)13-7-2-3-8-14(13)18(15)21/h2-10H,1H3.
What are the key properties of 3-(3-methoxyphenyl)indeno[1,2-c]pyridazin-5-one?
3-(3-methoxyphenyl)indeno[1,2-c]pyridazin-5-one has a molecular weight of 288.31 g/mol, XLogP of 3.36, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-methoxyphenyl)indeno[1,2-c]pyridazin-5-one is sourced from PubChem (CID 10469356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).