7-ethyl-4-(2-phenoxy-4-pyridinyl)imidazo[4,5-c]pyridazine

C18H15N5O — CID 155562113

IUPAC7-ethyl-4-(2-phenoxy-4-pyridinyl)imidazo[4,5-c]pyridazine
SMILESCCn1cnc2c(-c3ccnc(Oc4ccccc4)c3)cnnc21
InChIInChI=1S/C18H15N5O/c1-2-23-12-20-17-15(11-21-22-18(17)23)13-8-9-19-16(10-13)24-14-6-4-3-5-7-14/h3-12H,2H2,1H3
InChIKeySMGGKEMFHXGXIW-UHFFFAOYSA-N
MW317.35 g/mol
LogP3.70
Rot. Bonds4

About 7-ethyl-4-(2-phenoxy-4-pyridinyl)imidazo[4,5-c]pyridazine

7-ethyl-4-(2-phenoxy-4-pyridinyl)imidazo[4,5-c]pyridazine (PubChem CID 155562113) has the molecular formula C18H15N5O and a molecular weight of 317.35 g/mol. Its IUPAC name is 7-ethyl-4-(2-phenoxy-4-pyridinyl)imidazo[4,5-c]pyridazine.

Molecular Properties

Compound Name7-ethyl-4-(2-phenoxy-4-pyridinyl)imidazo[4,5-c]pyridazine
PubChem CID155562113
Molecular FormulaC18H15N5O
Molecular Weight317.35 g/mol
Exact Mass317.13
IUPAC Name7-ethyl-4-(2-phenoxy-4-pyridinyl)imidazo[4,5-c]pyridazine
SMILESCCn1cnc2c(-c3ccnc(Oc4ccccc4)c3)cnnc21
InChIInChI=1S/C18H15N5O/c1-2-23-12-20-17-15(11-21-22-18(17)23)13-8-9-19-16(10-13)24-14-6-4-3-5-7-14/h3-12H,2H2,1H3
InChIKeySMGGKEMFHXGXIW-UHFFFAOYSA-N
XLogP3.70
TPSA65.72 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.35
LogP ≤ 53.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 7-ethyl-4-(2-phenoxy-4-pyridinyl)imidazo[4,5-c]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

CID 90217848
CID 90217848
[3-(7-ethylimidazo[4,5-c]pyridazin-4-yl)phenyl]boronic acid
CID 90217850
3-[5-(7-ethylimidazo[4,5-c]pyridazin-4-yl)-2-fluorophenyl]-2-methoxy-1,8-naphthyridine
CID 169156271
7-ethyl-4-[3-(4-ethyl-2-methoxyphenyl)-4-fluorophenyl]imidazo[4,5-c]pyridazine
CID 175962275
3-[5-(7-ethylimidazo[4,5-c]pyridazin-4-yl)-2-fluorophenyl]-N-methylbenzamide
CID 130200333
4-chloro-7-ethylimidazo[4,5-c]pyridazine
CID 55296765
7-ethyl-4-[4-fluoro-3-(7-methoxy-1-methylindazol-6-yl)phenyl]imidazo[4,5-c]pyridazine
CID 170334739
5-[5-(7-ethylimidazo[4,5-c]pyridazin-4-yl)-2-fluorophenyl]-6-methoxy-1,2-benzoxazole
CID 170335103
7-ethyl-4-[4-fluoro-3-[2-methoxy-4-[(1S)-1-methylsulfonylethyl]phenyl]phenyl]imidazo[4,5-c]pyridazine
CID 175946639
7-ethyl-4-[4-fluoro-3-[4-methoxy-1-(oxetan-3-yl)benzimidazol-5-yl]phenyl]imidazo[4,5-c]pyridazine
CID 175489142
4-[3-(4-cyclopropylsulfonyl-2-methoxyphenyl)-4-fluorophenyl]-7-ethylimidazo[4,5-c]pyridazine
CID 90218258
9-ethyl-2-(3-methoxy-4-phenylpyrazol-1-yl)-6-pyridin-3-ylpurine
CID 168921523

Frequently Asked Questions

What is the IUPAC name of 7-ethyl-4-(2-phenoxy-4-pyridinyl)imidazo[4,5-c]pyridazine?
The IUPAC name of 7-ethyl-4-(2-phenoxy-4-pyridinyl)imidazo[4,5-c]pyridazine (CID 155562113) is 7-ethyl-4-(2-phenoxy-4-pyridinyl)imidazo[4,5-c]pyridazine.
What is the SMILES notation for 7-ethyl-4-(2-phenoxy-4-pyridinyl)imidazo[4,5-c]pyridazine?
The canonical SMILES for 7-ethyl-4-(2-phenoxy-4-pyridinyl)imidazo[4,5-c]pyridazine is CCn1cnc2c(-c3ccnc(Oc4ccccc4)c3)cnnc21.
What is the InChIKey of 7-ethyl-4-(2-phenoxy-4-pyridinyl)imidazo[4,5-c]pyridazine?
The InChIKey is SMGGKEMFHXGXIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15N5O/c1-2-23-12-20-17-15(11-21-22-18(17)23)13-8-9-19-16(10-13)24-14-6-4-3-5-7-14/h3-12H,2H2,1H3.
What are the key properties of 7-ethyl-4-(2-phenoxy-4-pyridinyl)imidazo[4,5-c]pyridazine?
7-ethyl-4-(2-phenoxy-4-pyridinyl)imidazo[4,5-c]pyridazine has a molecular weight of 317.35 g/mol, XLogP of 3.70, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-ethyl-4-(2-phenoxy-4-pyridinyl)imidazo[4,5-c]pyridazine is sourced from PubChem (CID 155562113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).