4-chloro-7-nitro-3-phenylquinolin-8-ol

C15H9ClN2O3 — CID 166150290

IUPAC4-chloro-7-nitro-3-phenylquinolin-8-ol
SMILESO=[N+]([O-])c1ccc2c(Cl)c(-c3ccccc3)cnc2c1O
InChIInChI=1S/C15H9ClN2O3/c16-13-10-6-7-12(18(20)21)15(19)14(10)17-8-11(13)9-4-2-1-3-5-9/h1-8,19H
InChIKeyDHLMPHUKGATCMF-UHFFFAOYSA-N
MW300.70 g/mol
LogP4.17
Rot. Bonds2

About 4-chloro-7-nitro-3-phenylquinolin-8-ol

4-chloro-7-nitro-3-phenylquinolin-8-ol (PubChem CID 166150290) has the molecular formula C15H9ClN2O3 and a molecular weight of 300.70 g/mol. Its IUPAC name is 4-chloro-7-nitro-3-phenylquinolin-8-ol.

Molecular Properties

Compound Name4-chloro-7-nitro-3-phenylquinolin-8-ol
PubChem CID166150290
Molecular FormulaC15H9ClN2O3
Molecular Weight300.70 g/mol
Exact Mass300.03
IUPAC Name4-chloro-7-nitro-3-phenylquinolin-8-ol
SMILESO=[N+]([O-])c1ccc2c(Cl)c(-c3ccccc3)cnc2c1O
InChIInChI=1S/C15H9ClN2O3/c16-13-10-6-7-12(18(20)21)15(19)14(10)17-8-11(13)9-4-2-1-3-5-9/h1-8,19H
InChIKeyDHLMPHUKGATCMF-UHFFFAOYSA-N
XLogP4.17
TPSA76.26 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.70
LogP ≤ 54.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

7-nitro-4-phenylquinolin-8-ol
CID 166150148
4-nitro-2,5-diphenylpyridine
CID 56647199
4-fluoro-7-nitroquinolin-8-ol
CID 166150161
3,4-dichloro-8-nitroquinoline
CID 19592722
5-chloro-2-deuterio-7-nitroquinolin-8-ol
CID 170982612
bis(4,7-diphenyl-1,10-phenanthroline);4-nitrobenzene-1,2-diol;ruthenium
CID 155727866
2-deuterio-7-nitroquinolin-8-ol
CID 170982608
4-chloro-8-methyl-3-nitro-1,7-naphthyridine
CID 103416471
4-chlorobenzoic acid;7-nitroquinolin-8-ol
CID 23620171
4-imidazol-1-yl-7-nitroquinolin-8-ol
CID 166150167
3-chloro-4-nitrobenzene-1,2-diol
CID 68960315
4-(2-nitrophenyl)-2-phenylpyridine
CID 102105042

Frequently Asked Questions

What is the IUPAC name of 4-chloro-7-nitro-3-phenylquinolin-8-ol?
The IUPAC name of 4-chloro-7-nitro-3-phenylquinolin-8-ol (CID 166150290) is 4-chloro-7-nitro-3-phenylquinolin-8-ol.
What is the SMILES notation for 4-chloro-7-nitro-3-phenylquinolin-8-ol?
The canonical SMILES for 4-chloro-7-nitro-3-phenylquinolin-8-ol is O=[N+]([O-])c1ccc2c(Cl)c(-c3ccccc3)cnc2c1O.
What is the InChIKey of 4-chloro-7-nitro-3-phenylquinolin-8-ol?
The InChIKey is DHLMPHUKGATCMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9ClN2O3/c16-13-10-6-7-12(18(20)21)15(19)14(10)17-8-11(13)9-4-2-1-3-5-9/h1-8,19H.
What are the key properties of 4-chloro-7-nitro-3-phenylquinolin-8-ol?
4-chloro-7-nitro-3-phenylquinolin-8-ol has a molecular weight of 300.70 g/mol, XLogP of 4.17, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-7-nitro-3-phenylquinolin-8-ol is sourced from PubChem (CID 166150290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).