1-phenylpyridazino[4,5-d]pyridazine-4,5-diamine

C12H10N6 — CID 53375996

IUPAC1-phenylpyridazino[4,5-d]pyridazine-4,5-diamine
SMILESNc1nncc2c(-c3ccccc3)nnc(N)c12
InChIInChI=1S/C12H10N6/c13-11-9-8(6-15-17-11)10(16-18-12(9)14)7-4-2-1-3-5-7/h1-6H,(H2,13,17)(H2,14,18)
InChIKeySWVCWIIJMCNOEW-UHFFFAOYSA-N
MW238.25 g/mol
LogP1.25
Rot. Bonds1

About 1-phenylpyridazino[4,5-d]pyridazine-4,5-diamine

1-phenylpyridazino[4,5-d]pyridazine-4,5-diamine (PubChem CID 53375996) has the molecular formula C12H10N6 and a molecular weight of 238.25 g/mol. Its IUPAC name is 1-phenylpyridazino[4,5-d]pyridazine-4,5-diamine.

Molecular Properties

Compound Name1-phenylpyridazino[4,5-d]pyridazine-4,5-diamine
PubChem CID53375996
Molecular FormulaC12H10N6
Molecular Weight238.25 g/mol
Exact Mass238.10
IUPAC Name1-phenylpyridazino[4,5-d]pyridazine-4,5-diamine
SMILESNc1nncc2c(-c3ccccc3)nnc(N)c12
InChIInChI=1S/C12H10N6/c13-11-9-8(6-15-17-11)10(16-18-12(9)14)7-4-2-1-3-5-7/h1-6H,(H2,13,17)(H2,14,18)
InChIKeySWVCWIIJMCNOEW-UHFFFAOYSA-N
XLogP1.25
TPSA103.60 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.25
LogP ≤ 51.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

1-phenylphthalazine
CID 609624
3,6-diphenyl-1,2,4-triazin-5-amine
CID 15532257
4-phenyl-5-propylphthalazin-1-amine
CID 57376011
4-(4-methylsulfanylphenyl)phthalazin-1-amine
CID 154206960
3-amino-5-methyl-6-phenylpyrazine-2-carbonitrile
CID 20567061
3-amino-5-benzyl-6-phenylpyridazine-4-carbonitrile
CID 102492843
6-phenylpyridazin-4-amine
CID 13068495
3-phenyl-1,2,4-triazin-5-amine
CID 15272334
1-phenyl-4-piperazin-1-ylpyridazino[4,5-d]pyridazine
CID 12782531
5-chloro-3,4-diphenylpyridazine
CID 70481559
5-(4-fluorophenyl)-4-phenyl-1H-pyrazolo[3,4-c]pyridazin-3-amine
CID 85068677
2,3,5,8-tetraphenylpyrazino[2,3-d]pyridazine
CID 134914577

Frequently Asked Questions

What is the IUPAC name of 1-phenylpyridazino[4,5-d]pyridazine-4,5-diamine?
The IUPAC name of 1-phenylpyridazino[4,5-d]pyridazine-4,5-diamine (CID 53375996) is 1-phenylpyridazino[4,5-d]pyridazine-4,5-diamine.
What is the SMILES notation for 1-phenylpyridazino[4,5-d]pyridazine-4,5-diamine?
The canonical SMILES for 1-phenylpyridazino[4,5-d]pyridazine-4,5-diamine is Nc1nncc2c(-c3ccccc3)nnc(N)c12.
What is the InChIKey of 1-phenylpyridazino[4,5-d]pyridazine-4,5-diamine?
The InChIKey is SWVCWIIJMCNOEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10N6/c13-11-9-8(6-15-17-11)10(16-18-12(9)14)7-4-2-1-3-5-7/h1-6H,(H2,13,17)(H2,14,18).
What are the key properties of 1-phenylpyridazino[4,5-d]pyridazine-4,5-diamine?
1-phenylpyridazino[4,5-d]pyridazine-4,5-diamine has a molecular weight of 238.25 g/mol, XLogP of 1.25, 1 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenylpyridazino[4,5-d]pyridazine-4,5-diamine is sourced from PubChem (CID 53375996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).