9-[3-(10,10-dimethyl-9-pyridin-2-ylanthracen-9-yl)benzene-2-id-1-yl]-2-pyridin-2-yl-1H-carbazol-1-ide;methane;pentakis(platinum(2+));2-pyridin-2-yl-9-[3-(1-pyridin-2-ylcyclobutyl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(1-pyridin-2-ylcyclohexyl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(1-pyridin-2-ylcyclopentyl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(5-pyridin-2-ylnonan-5-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide

C183H153N15Pt5 — CID 161267763

IUPAC9-[3-(10,10-dimethyl-9-pyridin-2-ylanthracen-9-yl)benzene-2-id-1-yl]-2-pyridin-2-yl-1H-carbazol-1-ide;methane;pentakis(platinum(2+));2-pyridin-2-yl-9-[3-(1-pyridin-2-ylcyclobutyl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(1-pyridin-2-ylcyclohexyl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(1-pyridin-2-ylcyclopentyl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(5-pyridin-2-ylnonan-5-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide
SMILESC.C.C.CC1(C)c2ccccc2C(c2[c-]c(-n3c4[c-]c(-c5ccccn5)ccc4c4ccccc43)ccc2)(c2ccccn2)c2ccccc21.CCCCC(CCCC)(c1[c-]c(-n2c3[c-]c(-c4ccccn4)ccc3c3ccccc32)ccc1)c1ccccn1.[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2].[c-]1c(-n2c3[c-]c(-c4ccccn4)ccc3c3ccccc32)cccc1C1(c2ccccn2)CCC1.[c-]1c(-n2c3[c-]c(-c4ccccn4)ccc3c3ccccc32)cccc1C1(c2ccccn2)CCCC1.[c-]1c(-n2c3[c-]c(-c4ccccn4)ccc3c3ccccc32)cccc1C1(c2ccccn2)CCCCC1
InChIInChI=1S/C44H31N3.C37H35N3.C34H27N3.C33H25N3.C32H23N3.3CH4.5Pt/c1-43(2)35-17-4-6-19-37(35)44(42-23-10-12-27-46-42,38-20-7-5-18-36(38)43)31-14-13-15-32(29-31)47-40-22-8-3-16-33(40)34-25-24-30(28-41(34)47)39-21-9-11-26-45-39;1-3-5-22-37(23-6-4-2,36-19-10-12-25-39-36)29-14-13-15-30(27-29)40-34-18-8-7-16-31(34)32-21-20-28(26-35(32)40)33-17-9-11-24-38-33;1-6-19-34(20-7-1,33-16-5-9-22-36-33)26-11-10-12-27(24-26)37-31-15-3-2-13-28(31)29-18-17-25(23-32(29)37)30-14-4-8-21-35-30;1-2-14-30-27(12-1)28-17-16-24(29-13-3-7-20-34-29)22-31(28)36(30)26-11-9-10-25(23-26)33(18-5-6-19-33)32-15-4-8-21-35-32;1-2-13-29-26(11-1)27-16-15-23(28-12-3-5-19-33-28)21-30(27)35(29)25-10-7-9-24(22-25)32(17-8-18-32)31-14-4-6-20-34-31;;;;;;;;/h3-27H,1-2H3;7-21,24-25H,3-6,22-23H2,1-2H3;2-5,8-18,21-22H,1,6-7,19-20H2;1-4,7-17,20-21H,5-6,18-19H2;1-7,9-16,19-20H,8,17-18H2;3*1H4;;;;;/q5*-2;;;;5*+2
InChIKeyJBNJIOHAXXYHBJ-UHFFFAOYSA-N
MW3537.73 g/mol
LogP44.37
Rot. Bonds26

About 9-[3-(10,10-dimethyl-9-pyridin-2-ylanthracen-9-yl)benzene-2-id-1-yl]-2-pyridin-2-yl-1H-carbazol-1-ide;methane;pentakis(platinum(2+));2-pyridin-2-yl-9-[3-(1-pyridin-2-ylcyclobutyl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(1-pyridin-2-ylcyclohexyl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(1-pyridin-2-ylcyclopentyl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(5-pyridin-2-ylnonan-5-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide

9-[3-(10,10-dimethyl-9-pyridin-2-ylanthracen-9-yl)benzene-2-id-1-yl]-2-pyridin-2-yl-1H-carbazol-1-ide;methane;pentakis(platinum(2+));2-pyridin-2-yl-9-[3-(1-pyridin-2-ylcyclobutyl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(1-pyridin-2-ylcyclohexyl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(1-pyridin-2-ylcyclopentyl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(5-pyridin-2-ylnonan-5-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide (PubChem CID 161267763) has the molecular formula C183H153N15Pt5 and a molecular weight of 3537.73 g/mol. Its IUPAC name is 9-[3-(10,10-dimethyl-9-pyridin-2-ylanthracen-9-yl)benzene-2-id-1-yl]-2-pyridin-2-yl-1H-carbazol-1-ide;methane;pentakis(platinum(2+));2-pyridin-2-yl-9-[3-(1-pyridin-2-ylcyclobutyl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(1-pyridin-2-ylcyclohexyl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(1-pyridin-2-ylcyclopentyl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(5-pyridin-2-ylnonan-5-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide.

Molecular Properties

Compound Name9-[3-(10,10-dimethyl-9-pyridin-2-ylanthracen-9-yl)benzene-2-id-1-yl]-2-pyridin-2-yl-1H-carbazol-1-ide;methane;pentakis(platinum(2+));2-pyridin-2-yl-9-[3-(1-pyridin-2-ylcyclobutyl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(1-pyridin-2-ylcyclohexyl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(1-pyridin-2-ylcyclopentyl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(5-pyridin-2-ylnonan-5-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide
PubChem CID161267763
Molecular FormulaC183H153N15Pt5
Molecular Weight3537.73 g/mol
Exact Mass3535.07
IUPAC Name9-[3-(10,10-dimethyl-9-pyridin-2-ylanthracen-9-yl)benzene-2-id-1-yl]-2-pyridin-2-yl-1H-carbazol-1-ide;methane;pentakis(platinum(2+));2-pyridin-2-yl-9-[3-(1-pyridin-2-ylcyclobutyl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(1-pyridin-2-ylcyclohexyl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(1-pyridin-2-ylcyclopentyl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(5-pyridin-2-ylnonan-5-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide
SMILESC.C.C.CC1(C)c2ccccc2C(c2[c-]c(-n3c4[c-]c(-c5ccccn5)ccc4c4ccccc43)ccc2)(c2ccccn2)c2ccccc21.CCCCC(CCCC)(c1[c-]c(-n2c3[c-]c(-c4ccccn4)ccc3c3ccccc32)ccc1)c1ccccn1.[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2].[c-]1c(-n2c3[c-]c(-c4ccccn4)ccc3c3ccccc32)cccc1C1(c2ccccn2)CCC1.[c-]1c(-n2c3[c-]c(-c4ccccn4)ccc3c3ccccc32)cccc1C1(c2ccccn2)CCCC1.[c-]1c(-n2c3[c-]c(-c4ccccn4)ccc3c3ccccc32)cccc1C1(c2ccccn2)CCCCC1
InChIInChI=1S/C44H31N3.C37H35N3.C34H27N3.C33H25N3.C32H23N3.3CH4.5Pt/c1-43(2)35-17-4-6-19-37(35)44(42-23-10-12-27-46-42,38-20-7-5-18-36(38)43)31-14-13-15-32(29-31)47-40-22-8-3-16-33(40)34-25-24-30(28-41(34)47)39-21-9-11-26-45-39;1-3-5-22-37(23-6-4-2,36-19-10-12-25-39-36)29-14-13-15-30(27-29)40-34-18-8-7-16-31(34)32-21-20-28(26-35(32)40)33-17-9-11-24-38-33;1-6-19-34(20-7-1,33-16-5-9-22-36-33)26-11-10-12-27(24-26)37-31-15-3-2-13-28(31)29-18-17-25(23-32(29)37)30-14-4-8-21-35-30;1-2-14-30-27(12-1)28-17-16-24(29-13-3-7-20-34-29)22-31(28)36(30)26-11-9-10-25(23-26)33(18-5-6-19-33)32-15-4-8-21-35-32;1-2-13-29-26(11-1)27-16-15-23(28-12-3-5-19-33-28)21-30(27)35(29)25-10-7-9-24(22-25)32(17-8-18-32)31-14-4-6-20-34-31;;;;;;;;/h3-27H,1-2H3;7-21,24-25H,3-6,22-23H2,1-2H3;2-5,8-18,21-22H,1,6-7,19-20H2;1-4,7-17,20-21H,5-6,18-19H2;1-7,9-16,19-20H,8,17-18H2;3*1H4;;;;;/q5*-2;;;;5*+2
InChIKeyJBNJIOHAXXYHBJ-UHFFFAOYSA-N
XLogP44.37
TPSA153.55 Ų
H-Bond Donors
H-Bond Acceptors15
Rotatable Bonds26
Heavy Atoms203
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003537.73
LogP ≤ 544.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1015

Computed Properties (RDKit)

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

Analyze 9-[3-(10,10-dimethyl-9-pyridin-2-ylanthracen-9-yl)benzene-2-id-1-yl]-2-pyridin-2-yl-1H-carbazol-1-ide;methane;pentakis(platinum(2+));2-pyridin-2-yl-9-[3-(1-pyridin-2-ylcyclobutyl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(1-pyridin-2-ylcyclohexyl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(1-pyridin-2-ylcyclopentyl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(5-pyridin-2-ylnonan-5-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 9-[3-(10,10-dimethyl-9-pyridin-2-ylanthracen-9-yl)benzene-2-id-1-yl]-2-pyridin-2-yl-1H-carbazol-1-ide;methane;pentakis(platinum(2+));2-pyridin-2-yl-9-[3-(1-pyridin-2-ylcyclobutyl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(1-pyridin-2-ylcyclohexyl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(1-pyridin-2-ylcyclopentyl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(5-pyridin-2-ylnonan-5-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide?
The IUPAC name of 9-[3-(10,10-dimethyl-9-pyridin-2-ylanthracen-9-yl)benzene-2-id-1-yl]-2-pyridin-2-yl-1H-carbazol-1-ide;methane;pentakis(platinum(2+));2-pyridin-2-yl-9-[3-(1-pyridin-2-ylcyclobutyl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(1-pyridin-2-ylcyclohexyl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(1-pyridin-2-ylcyclopentyl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(5-pyridin-2-ylnonan-5-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide (CID 161267763) is 9-[3-(10,10-dimethyl-9-pyridin-2-ylanthracen-9-yl)benzene-2-id-1-yl]-2-pyridin-2-yl-1H-carbazol-1-ide;methane;pentakis(platinum(2+));2-pyridin-2-yl-9-[3-(1-pyridin-2-ylcyclobutyl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(1-pyridin-2-ylcyclohexyl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(1-pyridin-2-ylcyclopentyl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(5-pyridin-2-ylnonan-5-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide.
What is the SMILES notation for 9-[3-(10,10-dimethyl-9-pyridin-2-ylanthracen-9-yl)benzene-2-id-1-yl]-2-pyridin-2-yl-1H-carbazol-1-ide;methane;pentakis(platinum(2+));2-pyridin-2-yl-9-[3-(1-pyridin-2-ylcyclobutyl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(1-pyridin-2-ylcyclohexyl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(1-pyridin-2-ylcyclopentyl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(5-pyridin-2-ylnonan-5-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide?
The canonical SMILES for 9-[3-(10,10-dimethyl-9-pyridin-2-ylanthracen-9-yl)benzene-2-id-1-yl]-2-pyridin-2-yl-1H-carbazol-1-ide;methane;pentakis(platinum(2+));2-pyridin-2-yl-9-[3-(1-pyridin-2-ylcyclobutyl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(1-pyridin-2-ylcyclohexyl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(1-pyridin-2-ylcyclopentyl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(5-pyridin-2-ylnonan-5-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide is C.C.C.CC1(C)c2ccccc2C(c2[c-]c(-n3c4[c-]c(-c5ccccn5)ccc4c4ccccc43)ccc2)(c2ccccn2)c2ccccc21.CCCCC(CCCC)(c1[c-]c(-n2c3[c-]c(-c4ccccn4)ccc3c3ccccc32)ccc1)c1ccccn1.[Pt+2].[Pt+2].[Pt+2].[Pt+2].[Pt+2].[c-]1c(-n2c3[c-]c(-c4ccccn4)ccc3c3ccccc32)cccc1C1(c2ccccn2)CCC1.[c-]1c(-n2c3[c-]c(-c4ccccn4)ccc3c3ccccc32)cccc1C1(c2ccccn2)CCCC1.[c-]1c(-n2c3[c-]c(-c4ccccn4)ccc3c3ccccc32)cccc1C1(c2ccccn2)CCCCC1.
What is the InChIKey of 9-[3-(10,10-dimethyl-9-pyridin-2-ylanthracen-9-yl)benzene-2-id-1-yl]-2-pyridin-2-yl-1H-carbazol-1-ide;methane;pentakis(platinum(2+));2-pyridin-2-yl-9-[3-(1-pyridin-2-ylcyclobutyl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(1-pyridin-2-ylcyclohexyl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(1-pyridin-2-ylcyclopentyl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(5-pyridin-2-ylnonan-5-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide?
The InChIKey is JBNJIOHAXXYHBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C44H31N3.C37H35N3.C34H27N3.C33H25N3.C32H23N3.3CH4.5Pt/c1-43(2)35-17-4-6-19-37(35)44(42-23-10-12-27-46-42,38-20-7-5-18-36(38)43)31-14-13-15-32(29-31)47-40-22-8-3-16-33(40)34-25-24-30(28-41(34)47)39-21-9-11-26-45-39;1-3-5-22-37(23-6-4-2,36-19-10-12-25-39-36)29-14-13-15-30(27-29)40-34-18-8-7-16-31(34)32-21-20-28(26-35(32)40)33-17-9-11-24-38-33;1-6-19-34(20-7-1,33-16-5-9-22-36-33)26-11-10-12-27(24-26)37-31-15-3-2-13-28(31)29-18-17-25(23-32(29)37)30-14-4-8-21-35-30;1-2-14-30-27(12-1)28-17-16-24(29-13-3-7-20-34-29)22-31(28)36(30)26-11-9-10-25(23-26)33(18-5-6-19-33)32-15-4-8-21-35-32;1-2-13-29-26(11-1)27-16-15-23(28-12-3-5-19-33-28)21-30(27)35(29)25-10-7-9-24(22-25)32(17-8-18-32)31-14-4-6-20-34-31;;;;;;;;/h3-27H,1-2H3;7-21,24-25H,3-6,22-23H2,1-2H3;2-5,8-18,21-22H,1,6-7,19-20H2;1-4,7-17,20-21H,5-6,18-19H2;1-7,9-16,19-20H,8,17-18H2;3*1H4;;;;;/q5*-2;;;;5*+2.
What are the key properties of 9-[3-(10,10-dimethyl-9-pyridin-2-ylanthracen-9-yl)benzene-2-id-1-yl]-2-pyridin-2-yl-1H-carbazol-1-ide;methane;pentakis(platinum(2+));2-pyridin-2-yl-9-[3-(1-pyridin-2-ylcyclobutyl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(1-pyridin-2-ylcyclohexyl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(1-pyridin-2-ylcyclopentyl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(5-pyridin-2-ylnonan-5-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide?
9-[3-(10,10-dimethyl-9-pyridin-2-ylanthracen-9-yl)benzene-2-id-1-yl]-2-pyridin-2-yl-1H-carbazol-1-ide;methane;pentakis(platinum(2+));2-pyridin-2-yl-9-[3-(1-pyridin-2-ylcyclobutyl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(1-pyridin-2-ylcyclohexyl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(1-pyridin-2-ylcyclopentyl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(5-pyridin-2-ylnonan-5-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide has a molecular weight of 3537.73 g/mol, XLogP of 44.37, 26 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[3-(10,10-dimethyl-9-pyridin-2-ylanthracen-9-yl)benzene-2-id-1-yl]-2-pyridin-2-yl-1H-carbazol-1-ide;methane;pentakis(platinum(2+));2-pyridin-2-yl-9-[3-(1-pyridin-2-ylcyclobutyl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(1-pyridin-2-ylcyclohexyl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(1-pyridin-2-ylcyclopentyl)benzene-2-id-1-yl]-1H-carbazol-1-ide;2-pyridin-2-yl-9-[3-(5-pyridin-2-ylnonan-5-yl)benzene-2-id-1-yl]-1H-carbazol-1-ide is sourced from PubChem (CID 161267763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).