4-(4-fluoro-2-methoxyphenyl)pyrido[3,4-d]pyridazin-1-amine

C14H11FN4O — CID 170279897

IUPAC4-(4-fluoro-2-methoxyphenyl)pyrido[3,4-d]pyridazin-1-amine
SMILESCOc1cc(F)ccc1-c1nnc(N)c2ccncc12
InChIInChI=1S/C14H11FN4O/c1-20-12-6-8(15)2-3-10(12)13-11-7-17-5-4-9(11)14(16)19-18-13/h2-7H,1H3,(H2,16,19)
InChIKeyACPHGZMVPAWPKU-UHFFFAOYSA-N
MW270.27 g/mol
LogP2.42
Rot. Bonds2

About 4-(4-fluoro-2-methoxyphenyl)pyrido[3,4-d]pyridazin-1-amine

4-(4-fluoro-2-methoxyphenyl)pyrido[3,4-d]pyridazin-1-amine (PubChem CID 170279897) has the molecular formula C14H11FN4O and a molecular weight of 270.27 g/mol. Its IUPAC name is 4-(4-fluoro-2-methoxyphenyl)pyrido[3,4-d]pyridazin-1-amine.

Molecular Properties

Compound Name4-(4-fluoro-2-methoxyphenyl)pyrido[3,4-d]pyridazin-1-amine
PubChem CID170279897
Molecular FormulaC14H11FN4O
Molecular Weight270.27 g/mol
Exact Mass270.09
IUPAC Name4-(4-fluoro-2-methoxyphenyl)pyrido[3,4-d]pyridazin-1-amine
SMILESCOc1cc(F)ccc1-c1nnc(N)c2ccncc12
InChIInChI=1S/C14H11FN4O/c1-20-12-6-8(15)2-3-10(12)13-11-7-17-5-4-9(11)14(16)19-18-13/h2-7H,1H3,(H2,16,19)
InChIKeyACPHGZMVPAWPKU-UHFFFAOYSA-N
XLogP2.42
TPSA73.92 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.27
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 4-(4-fluoro-2-methoxyphenyl)pyrido[3,4-d]pyridazin-1-amine 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

4-(5-fluoro-2-methoxyphenyl)pyridin-3-amine
CID 70663373
1-[2-[(4-methoxyphenyl)methoxy]-4-(trifluoromethyl)phenyl]pyrido[3,4-d]pyridazin-4-amine
CID 166456018
4-(4-fluoro-2-methoxyphenyl)-N-methylpyridin-3-amine
CID 70663207
4-(3-fluoro-4-pyridinyl)phthalazin-1-amine
CID 104739186
4-(4-fluoro-2-methoxyphenyl)-1,2-oxazol-5-amine
CID 117297113
4-(4-fluoro-2-methoxyphenyl)-1H-pyrazol-5-amine
CID 117295551
N-[4-(4-fluoro-2-methoxyphenyl)-3-pyridinyl]acetamide
CID 140628304
1-(4-chloro-2-methoxyphenyl)pyrido[3,4-d]pyridazine
CID 175937702
6-(4-fluoro-2-methoxyphenyl)-2-methyl-5-pyridin-2-ylpyrimidin-4-amine
CID 90159712
5-(4-fluoro-2-methoxyphenyl)-1,6-naphthyridine
CID 162630412
3-(4-fluoro-2-methoxyanilino)pyridine-4-carbothioamide
CID 114288348
3-(2-amino-4-fluorophenyl)pyridin-4-amine
CID 154474291

Frequently Asked Questions

What is the IUPAC name of 4-(4-fluoro-2-methoxyphenyl)pyrido[3,4-d]pyridazin-1-amine?
The IUPAC name of 4-(4-fluoro-2-methoxyphenyl)pyrido[3,4-d]pyridazin-1-amine (CID 170279897) is 4-(4-fluoro-2-methoxyphenyl)pyrido[3,4-d]pyridazin-1-amine.
What is the SMILES notation for 4-(4-fluoro-2-methoxyphenyl)pyrido[3,4-d]pyridazin-1-amine?
The canonical SMILES for 4-(4-fluoro-2-methoxyphenyl)pyrido[3,4-d]pyridazin-1-amine is COc1cc(F)ccc1-c1nnc(N)c2ccncc12.
What is the InChIKey of 4-(4-fluoro-2-methoxyphenyl)pyrido[3,4-d]pyridazin-1-amine?
The InChIKey is ACPHGZMVPAWPKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11FN4O/c1-20-12-6-8(15)2-3-10(12)13-11-7-17-5-4-9(11)14(16)19-18-13/h2-7H,1H3,(H2,16,19).
What are the key properties of 4-(4-fluoro-2-methoxyphenyl)pyrido[3,4-d]pyridazin-1-amine?
4-(4-fluoro-2-methoxyphenyl)pyrido[3,4-d]pyridazin-1-amine has a molecular weight of 270.27 g/mol, XLogP of 2.42, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-fluoro-2-methoxyphenyl)pyrido[3,4-d]pyridazin-1-amine is sourced from PubChem (CID 170279897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).