4-amino-5-nitroso-3-phenyl-1H-pyridazin-6-one

C10H8N4O2 — CID 10443288

IUPAC4-amino-5-nitroso-3-phenyl-1H-pyridazin-6-one
SMILESNc1c(-c2ccccc2)n[nH]c(=O)c1N=O
InChIInChI=1S/C10H8N4O2/c11-7-8(6-4-2-1-3-5-6)12-13-10(15)9(7)14-16/h1-5H,(H3,11,13,15)
InChIKeyVINRTMZLVSWHEV-UHFFFAOYSA-N
MW216.20 g/mol
LogP1.42
Rot. Bonds2

About 4-amino-5-nitroso-3-phenyl-1H-pyridazin-6-one

4-amino-5-nitroso-3-phenyl-1H-pyridazin-6-one (PubChem CID 10443288) has the molecular formula C10H8N4O2 and a molecular weight of 216.20 g/mol. Its IUPAC name is 4-amino-5-nitroso-3-phenyl-1H-pyridazin-6-one.

Molecular Properties

Compound Name4-amino-5-nitroso-3-phenyl-1H-pyridazin-6-one
PubChem CID10443288
Molecular FormulaC10H8N4O2
Molecular Weight216.20 g/mol
Exact Mass216.06
IUPAC Name4-amino-5-nitroso-3-phenyl-1H-pyridazin-6-one
SMILESNc1c(-c2ccccc2)n[nH]c(=O)c1N=O
InChIInChI=1S/C10H8N4O2/c11-7-8(6-4-2-1-3-5-6)12-13-10(15)9(7)14-16/h1-5H,(H3,11,13,15)
InChIKeyVINRTMZLVSWHEV-UHFFFAOYSA-N
XLogP1.42
TPSA101.20 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.20
LogP ≤ 51.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-nitroso-3,5-diphenyl-1H-pyrazole
CID 15566459
4-phenyl-2H-phthalazin-1-one;hydrate
CID 51057017
6-phenyl-4,5-diazapentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),5,9,11,13,15,17,19-octaen-3-one
CID 24751534
2-amino-7-phenyl-5H-[1,3]thiazolo[4,5-d]pyridazin-4-one
CID 42281614
6-chloro-4-phenyl-2H-phthalazin-1-one
CID 134109277
tert-butyl N-(4-amino-6-oxo-3-phenyl-1H-pyridazin-5-yl)-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate
CID 11682805
5-methyl-3,4-diphenyl-1H-pyridazin-6-one
CID 13078220
5-diazonio-6-oxo-3-phenyl-1H-pyridazin-4-olate
CID 110272737
4-phenyl-2,6,7,8-tetrahydrocyclopenta[g]phthalazin-1-one
CID 15190690
4-(3-aminophenyl)-2H-phthalazin-1-one;hydrochloride
CID 157040138
4-chloro-5-fluoro-3-phenyl-1H-pyridazin-6-one
CID 88667827
5-amino-3-(4-methylphenyl)-6-oxo-1H-pyridazine-4-carboxylic acid
CID 68895150

Frequently Asked Questions

What is the IUPAC name of 4-amino-5-nitroso-3-phenyl-1H-pyridazin-6-one?
The IUPAC name of 4-amino-5-nitroso-3-phenyl-1H-pyridazin-6-one (CID 10443288) is 4-amino-5-nitroso-3-phenyl-1H-pyridazin-6-one.
What is the SMILES notation for 4-amino-5-nitroso-3-phenyl-1H-pyridazin-6-one?
The canonical SMILES for 4-amino-5-nitroso-3-phenyl-1H-pyridazin-6-one is Nc1c(-c2ccccc2)n[nH]c(=O)c1N=O.
What is the InChIKey of 4-amino-5-nitroso-3-phenyl-1H-pyridazin-6-one?
The InChIKey is VINRTMZLVSWHEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8N4O2/c11-7-8(6-4-2-1-3-5-6)12-13-10(15)9(7)14-16/h1-5H,(H3,11,13,15).
What are the key properties of 4-amino-5-nitroso-3-phenyl-1H-pyridazin-6-one?
4-amino-5-nitroso-3-phenyl-1H-pyridazin-6-one has a molecular weight of 216.20 g/mol, XLogP of 1.42, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-5-nitroso-3-phenyl-1H-pyridazin-6-one is sourced from PubChem (CID 10443288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).