1-[(4-methoxyphenyl)methyl]-2-methylpyrrolo[2,3-d]pyridazine

C15H15N3O — CID 19437773

IUPAC1-[(4-methoxyphenyl)methyl]-2-methylpyrrolo[2,3-d]pyridazine
SMILESCOc1ccc(Cn2c(C)cc3cnncc32)cc1
InChIInChI=1S/C15H15N3O/c1-11-7-13-8-16-17-9-15(13)18(11)10-12-3-5-14(19-2)6-4-12/h3-9H,10H2,1-2H3
InChIKeyDITZHSLPSASSEG-UHFFFAOYSA-N
MW253.31 g/mol
LogP2.80
Rot. Bonds3

About 1-[(4-methoxyphenyl)methyl]-2-methylpyrrolo[2,3-d]pyridazine

1-[(4-methoxyphenyl)methyl]-2-methylpyrrolo[2,3-d]pyridazine (PubChem CID 19437773) has the molecular formula C15H15N3O and a molecular weight of 253.31 g/mol. Its IUPAC name is 1-[(4-methoxyphenyl)methyl]-2-methylpyrrolo[2,3-d]pyridazine.

Molecular Properties

Compound Name1-[(4-methoxyphenyl)methyl]-2-methylpyrrolo[2,3-d]pyridazine
PubChem CID19437773
Molecular FormulaC15H15N3O
Molecular Weight253.31 g/mol
Exact Mass253.12
IUPAC Name1-[(4-methoxyphenyl)methyl]-2-methylpyrrolo[2,3-d]pyridazine
SMILESCOc1ccc(Cn2c(C)cc3cnncc32)cc1
InChIInChI=1S/C15H15N3O/c1-11-7-13-8-16-17-9-15(13)18(11)10-12-3-5-14(19-2)6-4-12/h3-9H,10H2,1-2H3
InChIKeyDITZHSLPSASSEG-UHFFFAOYSA-N
XLogP2.80
TPSA39.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.31
LogP ≤ 52.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 1-[(4-methoxyphenyl)methyl]-2-methylpyrrolo[2,3-d]pyridazine 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

5-fluoro-1-[(4-methoxyphenyl)methyl]-2-methylindole
CID 174227358
4-[(5-methoxy-2-methylindol-1-yl)methyl]aniline
CID 19779449
5-[(4-methoxyphenyl)methyl]-6-methyl-1-(oxetan-3-yl)pyrazolo[4,5-c]pyridin-4-one
CID 131984798
1-[(3,5-dichloro-2-pyridinyl)methyl]-5-methoxy-2-methylindole
CID 141347653
1-[2-(4-methoxyphenyl)ethyl]-2-methylindole
CID 65444625
5,6-dichloro-2-(4-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]benzimidazole
CID 163409698
3-[4-[[4-[(5-methoxy-2-methylindol-1-yl)methyl]phenyl]methoxy]phenyl]propanoic acid
CID 23159997
6-chloro-1,3-bis[(4-methoxyphenyl)methyl]pyrimidine-2,4-dione
CID 57423840
1-[(4-methoxyphenyl)methyl]-2,5,6-trimethylbenzimidazol-4-amine
CID 1479156
1-[(4-methoxyphenyl)methyl]quinoxalin-2-one
CID 15497841
1-[(4-methoxyphenyl)methyl]-5-[(4-methoxyphenyl)methylsulfanyl]-2-methylimidazole
CID 167320879
4-hydroxy-7-methoxy-1-[(4-methoxyphenyl)methyl]-3-methyl-1,5-naphthyridin-2-one
CID 167037612

Frequently Asked Questions

What is the IUPAC name of 1-[(4-methoxyphenyl)methyl]-2-methylpyrrolo[2,3-d]pyridazine?
The IUPAC name of 1-[(4-methoxyphenyl)methyl]-2-methylpyrrolo[2,3-d]pyridazine (CID 19437773) is 1-[(4-methoxyphenyl)methyl]-2-methylpyrrolo[2,3-d]pyridazine.
What is the SMILES notation for 1-[(4-methoxyphenyl)methyl]-2-methylpyrrolo[2,3-d]pyridazine?
The canonical SMILES for 1-[(4-methoxyphenyl)methyl]-2-methylpyrrolo[2,3-d]pyridazine is COc1ccc(Cn2c(C)cc3cnncc32)cc1.
What is the InChIKey of 1-[(4-methoxyphenyl)methyl]-2-methylpyrrolo[2,3-d]pyridazine?
The InChIKey is DITZHSLPSASSEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O/c1-11-7-13-8-16-17-9-15(13)18(11)10-12-3-5-14(19-2)6-4-12/h3-9H,10H2,1-2H3.
What are the key properties of 1-[(4-methoxyphenyl)methyl]-2-methylpyrrolo[2,3-d]pyridazine?
1-[(4-methoxyphenyl)methyl]-2-methylpyrrolo[2,3-d]pyridazine has a molecular weight of 253.31 g/mol, XLogP of 2.80, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4-methoxyphenyl)methyl]-2-methylpyrrolo[2,3-d]pyridazine is sourced from PubChem (CID 19437773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).