7-cyclopentyl-2-[[4-methyl-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]quinolin-8-ol;platinum

C33H28N3O2Pt- — CID 176606358

IUPAC7-cyclopentyl-2-[[4-methyl-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]quinolin-8-ol;platinum
SMILESCc1ccnc(-n2c3[c-]c(Oc4ccc5ccc(C6CCCC6)c(O)c5n4)cc(C)c3c3ccccc32)c1.[Pt]
InChIInChI=1S/C33H28N3O2.Pt/c1-20-15-16-34-29(17-20)36-27-10-6-5-9-26(27)31-21(2)18-24(19-28(31)36)38-30-14-12-23-11-13-25(22-7-3-4-8-22)33(37)32(23)35-30;/h5-6,9-18,22,37H,3-4,7-8H2,1-2H3;/q-1;
InChIKeyCGQJICSFRIQARA-UHFFFAOYSA-N
MW693.68 g/mol
LogP8.30
Rot. Bonds4

About 7-cyclopentyl-2-[[4-methyl-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]quinolin-8-ol;platinum

7-cyclopentyl-2-[[4-methyl-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]quinolin-8-ol;platinum (PubChem CID 176606358) has the molecular formula C33H28N3O2Pt- and a molecular weight of 693.68 g/mol. Its IUPAC name is 7-cyclopentyl-2-[[4-methyl-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]quinolin-8-ol;platinum.

Molecular Properties

Compound Name7-cyclopentyl-2-[[4-methyl-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]quinolin-8-ol;platinum
PubChem CID176606358
Molecular FormulaC33H28N3O2Pt-
Molecular Weight693.68 g/mol
Exact Mass693.18
IUPAC Name7-cyclopentyl-2-[[4-methyl-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]quinolin-8-ol;platinum
SMILESCc1ccnc(-n2c3[c-]c(Oc4ccc5ccc(C6CCCC6)c(O)c5n4)cc(C)c3c3ccccc32)c1.[Pt]
InChIInChI=1S/C33H28N3O2.Pt/c1-20-15-16-34-29(17-20)36-27-10-6-5-9-26(27)31-21(2)18-24(19-28(31)36)38-30-14-12-23-11-13-25(22-7-3-4-8-22)33(37)32(23)35-30;/h5-6,9-18,22,37H,3-4,7-8H2,1-2H3;/q-1;
InChIKeyCGQJICSFRIQARA-UHFFFAOYSA-N
XLogP8.30
TPSA60.17 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms39
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500693.68
LogP ≤ 58.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

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Related Compounds

7-ethyl-2-[(4-methyl-9-pyridin-2-yl-1H-carbazol-1-id-2-yl)oxy]quinolin-8-ol;platinum
CID 176606621
2-[[9-(4-methyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]-7-phenylquinolin-8-ol;platinum
CID 176606763
4,6-diethyl-2-[[4-ethyl-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]quinolin-8-ol;platinum
CID 176606455
5-tert-butyl-2-[[9-(4-methyl-2-pyridinyl)-4-propan-2-yl-1H-carbazol-1-id-2-yl]oxy]quinolin-8-ol;platinum
CID 176606680
2-[[9-(4-phenyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzo[g]quinolin-10-ol;platinum
CID 176606872
5,7-dimethyl-2-[(9-pyridin-2-yl-1H-carbazol-1-id-2-yl)oxy]quinolin-8-ol;platinum
CID 176605982
2-[(4,7-dimethyl-9-pyridin-2-yl-1H-carbazol-1-id-2-yl)oxy]-3,6,7-trimethylquinolin-8-ol;platinum
CID 176606417
2-[[9-(4-cyclopentyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]-4,5-diphenylquinolin-8-ol;platinum
CID 176605949
5-tert-butyl-2-[[9-(4-methyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]quinoline-8-thiolate;platinum(2+)
CID 176606440
3-methyl-2-[[6-methyl-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]quinolin-8-ol;platinum
CID 176605761
4,5-dimethyl-2-[[9-(4-propan-2-yl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]quinolin-8-ol;platinum
CID 176606282
2-[[9-[4-(dimethylamino)-2-pyridinyl]-1H-carbazol-1-id-2-yl]oxy]-4-methylquinolin-8-ol;platinum
CID 176605947

Frequently Asked Questions

What is the IUPAC name of 7-cyclopentyl-2-[[4-methyl-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]quinolin-8-ol;platinum?
The IUPAC name of 7-cyclopentyl-2-[[4-methyl-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]quinolin-8-ol;platinum (CID 176606358) is 7-cyclopentyl-2-[[4-methyl-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]quinolin-8-ol;platinum.
What is the SMILES notation for 7-cyclopentyl-2-[[4-methyl-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]quinolin-8-ol;platinum?
The canonical SMILES for 7-cyclopentyl-2-[[4-methyl-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]quinolin-8-ol;platinum is Cc1ccnc(-n2c3[c-]c(Oc4ccc5ccc(C6CCCC6)c(O)c5n4)cc(C)c3c3ccccc32)c1.[Pt].
What is the InChIKey of 7-cyclopentyl-2-[[4-methyl-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]quinolin-8-ol;platinum?
The InChIKey is CGQJICSFRIQARA-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H28N3O2.Pt/c1-20-15-16-34-29(17-20)36-27-10-6-5-9-26(27)31-21(2)18-24(19-28(31)36)38-30-14-12-23-11-13-25(22-7-3-4-8-22)33(37)32(23)35-30;/h5-6,9-18,22,37H,3-4,7-8H2,1-2H3;/q-1;.
What are the key properties of 7-cyclopentyl-2-[[4-methyl-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]quinolin-8-ol;platinum?
7-cyclopentyl-2-[[4-methyl-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]quinolin-8-ol;platinum has a molecular weight of 693.68 g/mol, XLogP of 8.30, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-cyclopentyl-2-[[4-methyl-9-(4-methyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]quinolin-8-ol;platinum is sourced from PubChem (CID 176606358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).