2-chloro-11-N',11-N',17-N',17-N'-tetraphenylspiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(15),2,4,6,8(13),9,11,16,18-nonaene]-11',17'-diamine

C55H37ClN2 — CID 130263577

IUPAC2-chloro-11-N',11-N',17-N',17-N'-tetraphenylspiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(15),2,4,6,8(13),9,11,16,18-nonaene]-11',17'-diamine
SMILESClc1ccc2c(c1)C1(c3cc(N(c4ccccc4)c4ccccc4)ccc3-c3ccccc3-c3ccc(N(c4ccccc4)c4ccccc4)cc31)c1ccccc1-2
InChIInChI=1S/C55H37ClN2/c56-38-29-32-50-47-27-15-16-28-51(47)55(52(50)35-38)53-36-43(57(39-17-5-1-6-18-39)40-19-7-2-8-20-40)30-33-48(53)45-25-13-14-26-46(45)49-34-31-44(37-54(49)55)58(41-21-9-3-10-22-41)42-23-11-4-12-24-42/h1-37H
InChIKeySUISRBGHKUDAOQ-UHFFFAOYSA-N
MW761.37 g/mol
LogP15.29
Rot. Bonds6

About 2-chloro-11-N',11-N',17-N',17-N'-tetraphenylspiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(15),2,4,6,8(13),9,11,16,18-nonaene]-11',17'-diamine

2-chloro-11-N',11-N',17-N',17-N'-tetraphenylspiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(15),2,4,6,8(13),9,11,16,18-nonaene]-11',17'-diamine (PubChem CID 130263577) has the molecular formula C55H37ClN2 and a molecular weight of 761.37 g/mol. Its IUPAC name is 2-chloro-11-N',11-N',17-N',17-N'-tetraphenylspiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(15),2,4,6,8(13),9,11,16,18-nonaene]-11',17'-diamine.

Molecular Properties

Compound Name2-chloro-11-N',11-N',17-N',17-N'-tetraphenylspiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(15),2,4,6,8(13),9,11,16,18-nonaene]-11',17'-diamine
PubChem CID130263577
Molecular FormulaC55H37ClN2
Molecular Weight761.37 g/mol
Exact Mass760.26
IUPAC Name2-chloro-11-N',11-N',17-N',17-N'-tetraphenylspiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(15),2,4,6,8(13),9,11,16,18-nonaene]-11',17'-diamine
SMILESClc1ccc2c(c1)C1(c3cc(N(c4ccccc4)c4ccccc4)ccc3-c3ccccc3-c3ccc(N(c4ccccc4)c4ccccc4)cc31)c1ccccc1-2
InChIInChI=1S/C55H37ClN2/c56-38-29-32-50-47-27-15-16-28-51(47)55(52(50)35-38)53-36-43(57(39-17-5-1-6-18-39)40-19-7-2-8-20-40)30-33-48(53)45-25-13-14-26-46(45)49-34-31-44(37-54(49)55)58(41-21-9-3-10-22-41)42-23-11-4-12-24-42/h1-37H
InChIKeySUISRBGHKUDAOQ-UHFFFAOYSA-N
XLogP15.29
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms58
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500761.37
LogP ≤ 515.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2-chloro-11-N',11-N',17-N',17-N'-tetraphenylspiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(15),2,4,6,8(13),9,11,16,18-nonaene]-11',17'-diamine with MolForge

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Related Compounds

N-(4-chlorophenyl)-N,9,9-triphenylfluoren-2-amine
CID 139762369
N-phenyl-N-(4-phenylphenyl)spiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaene]-11'-amine
CID 155079035
7'-chloro-N-naphthalen-1-yl-N-phenyl-9,9'-spirobi[fluorene]-2'-amine
CID 165158317
N-(3,4-diphenylphenyl)-N-phenyl-9,9'-spirobi[fluorene]-2-amine
CID 155114306
N-(4-phenylphenyl)-N-(9,9'-spirobi[fluorene]-2-yl)spiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8,10,12,15,17-nonaene]-2-amine
CID 121391582
N-phenyl-N-spiro[fluorene-9,9'-thioxanthene]-2-ylspiro[fluorene-9,9'-thioxanthene]-2-amine
CID 138476029
3'-chloro-N-phenyl-N-(4-phenylphenyl)-9,9'-spirobi[fluorene]-3-amine
CID 146539095
N-(4-phenylphenyl)-N-(9,9'-spirobi[fluorene]-2-yl)-9,9'-spirobi[fluorene]-2-amine
CID 118641092
N-(4-phenylphenyl)-N-[3-phenyl-4-(2-phenylphenyl)phenyl]-9,9'-spirobi[fluorene]-2-amine
CID 121477535
N,N-diphenylspiro[benzo[b]fluorene-11,9'-fluorene]-2-amine
CID 134193979
N-phenyl-N-(9,9'-spirobi[fluorene]-2-yl)spiro[benzo[b]fluorene-11,9'-fluorene]-2'-amine
CID 134215993
N-(3-chlorophenyl)-9,9-diphenyl-N-(4-phenylphenyl)fluoren-2-amine
CID 90154262

Frequently Asked Questions

What is the IUPAC name of 2-chloro-11-N',11-N',17-N',17-N'-tetraphenylspiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(15),2,4,6,8(13),9,11,16,18-nonaene]-11',17'-diamine?
The IUPAC name of 2-chloro-11-N',11-N',17-N',17-N'-tetraphenylspiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(15),2,4,6,8(13),9,11,16,18-nonaene]-11',17'-diamine (CID 130263577) is 2-chloro-11-N',11-N',17-N',17-N'-tetraphenylspiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(15),2,4,6,8(13),9,11,16,18-nonaene]-11',17'-diamine.
What is the SMILES notation for 2-chloro-11-N',11-N',17-N',17-N'-tetraphenylspiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(15),2,4,6,8(13),9,11,16,18-nonaene]-11',17'-diamine?
The canonical SMILES for 2-chloro-11-N',11-N',17-N',17-N'-tetraphenylspiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(15),2,4,6,8(13),9,11,16,18-nonaene]-11',17'-diamine is Clc1ccc2c(c1)C1(c3cc(N(c4ccccc4)c4ccccc4)ccc3-c3ccccc3-c3ccc(N(c4ccccc4)c4ccccc4)cc31)c1ccccc1-2.
What is the InChIKey of 2-chloro-11-N',11-N',17-N',17-N'-tetraphenylspiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(15),2,4,6,8(13),9,11,16,18-nonaene]-11',17'-diamine?
The InChIKey is SUISRBGHKUDAOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C55H37ClN2/c56-38-29-32-50-47-27-15-16-28-51(47)55(52(50)35-38)53-36-43(57(39-17-5-1-6-18-39)40-19-7-2-8-20-40)30-33-48(53)45-25-13-14-26-46(45)49-34-31-44(37-54(49)55)58(41-21-9-3-10-22-41)42-23-11-4-12-24-42/h1-37H.
What are the key properties of 2-chloro-11-N',11-N',17-N',17-N'-tetraphenylspiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(15),2,4,6,8(13),9,11,16,18-nonaene]-11',17'-diamine?
2-chloro-11-N',11-N',17-N',17-N'-tetraphenylspiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(15),2,4,6,8(13),9,11,16,18-nonaene]-11',17'-diamine has a molecular weight of 761.37 g/mol, XLogP of 15.29, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-11-N',11-N',17-N',17-N'-tetraphenylspiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(15),2,4,6,8(13),9,11,16,18-nonaene]-11',17'-diamine is sourced from PubChem (CID 130263577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).