3-phenyl-1,5-dihydropyrazolo[4,5-c]quinolin-4-one

C16H11N3O — CID 136740229

IUPAC3-phenyl-1,5-dihydropyrazolo[4,5-c]quinolin-4-one
SMILESO=c1[nH]c2ccccc2c2[nH]nc(-c3ccccc3)c12
InChIInChI=1S/C16H11N3O/c20-16-13-14(10-6-2-1-3-7-10)18-19-15(13)11-8-4-5-9-12(11)17-16/h1-9H,(H,17,20)(H,18,19)
InChIKeyXOLYWTVOTNJPCB-UHFFFAOYSA-N
MW261.28 g/mol
LogP3.07
Rot. Bonds1

About 3-phenyl-1,5-dihydropyrazolo[4,5-c]quinolin-4-one

3-phenyl-1,5-dihydropyrazolo[4,5-c]quinolin-4-one (PubChem CID 136740229) has the molecular formula C16H11N3O and a molecular weight of 261.28 g/mol. Its IUPAC name is 3-phenyl-1,5-dihydropyrazolo[4,5-c]quinolin-4-one.

Molecular Properties

Compound Name3-phenyl-1,5-dihydropyrazolo[4,5-c]quinolin-4-one
PubChem CID136740229
Molecular FormulaC16H11N3O
Molecular Weight261.28 g/mol
Exact Mass261.09
IUPAC Name3-phenyl-1,5-dihydropyrazolo[4,5-c]quinolin-4-one
SMILESO=c1[nH]c2ccccc2c2[nH]nc(-c3ccccc3)c12
InChIInChI=1S/C16H11N3O/c20-16-13-14(10-6-2-1-3-7-10)18-19-15(13)11-8-4-5-9-12(11)17-16/h1-9H,(H,17,20)(H,18,19)
InChIKeyXOLYWTVOTNJPCB-UHFFFAOYSA-N
XLogP3.07
TPSA61.54 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.28
LogP ≤ 53.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-phenyl-2,5-dihydropyridazino[4,5-b]indole-1-thione
CID 135541581
4-phenyl-2H-phthalazin-1-one;hydrate
CID 51057017
fluoroform;3-phenyl-1H-indazole
CID 160622015
ethane;4-phenyl-1H-quinazolin-2-one
CID 159100188
1-naphthalen-2-yl-3,5-dihydropyridazino[4,5-b]indol-4-one
CID 135900483
4-ethyl-3-phenyl-6H-pyridazino[4,3-c]quinolin-5-one
CID 91824336
3-(3,5-diphenylphenyl)-1H-indazole
CID 142357512
3-phenyl-1-pyridin-2-yl-5H-pyrazolo[4,5-c]quinolin-4-one
CID 136740236
4-amino-3-phenyl-1H-quinolin-2-one
CID 2784967
4-[4-(3-phenylphenyl)phenyl]-1H-quinazolin-2-one
CID 144815674
4,9,19-triazapentacyclo[10.7.0.02,6.07,11.013,18]nonadeca-1,6,11,13,15,17-hexaene-3,5,8,10-tetrone
CID 10086414
3,12,14,23-tetrazahexacyclo[14.7.0.02,10.04,9.011,15.017,22]tricosa-1(16),2(10),4,6,8,11(15),17,19,21-nonaen-13-one
CID 10638837

Frequently Asked Questions

What is the IUPAC name of 3-phenyl-1,5-dihydropyrazolo[4,5-c]quinolin-4-one?
The IUPAC name of 3-phenyl-1,5-dihydropyrazolo[4,5-c]quinolin-4-one (CID 136740229) is 3-phenyl-1,5-dihydropyrazolo[4,5-c]quinolin-4-one.
What is the SMILES notation for 3-phenyl-1,5-dihydropyrazolo[4,5-c]quinolin-4-one?
The canonical SMILES for 3-phenyl-1,5-dihydropyrazolo[4,5-c]quinolin-4-one is O=c1[nH]c2ccccc2c2[nH]nc(-c3ccccc3)c12.
What is the InChIKey of 3-phenyl-1,5-dihydropyrazolo[4,5-c]quinolin-4-one?
The InChIKey is XOLYWTVOTNJPCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11N3O/c20-16-13-14(10-6-2-1-3-7-10)18-19-15(13)11-8-4-5-9-12(11)17-16/h1-9H,(H,17,20)(H,18,19).
What are the key properties of 3-phenyl-1,5-dihydropyrazolo[4,5-c]quinolin-4-one?
3-phenyl-1,5-dihydropyrazolo[4,5-c]quinolin-4-one has a molecular weight of 261.28 g/mol, XLogP of 3.07, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-phenyl-1,5-dihydropyrazolo[4,5-c]quinolin-4-one is sourced from PubChem (CID 136740229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).