N-(11,11-dimethylbenzo[a]fluoren-9-yl)-11,11-dimethyl-N-(4-methylphenyl)benzo[a]fluoren-9-amine;N-(11,11-dimethylbenzo[a]fluoren-9-yl)-11,11-dimethyl-N-phenylbenzo[a]fluoren-9-amine;11,11-dimethyl-N,N-bis(4-phenylphenyl)benzo[a]fluoren-9-amine;11,11-dimethyl-N-phenyl-N-(4-phenylphenyl)benzo[a]fluoren-9-amine

C169H134N4 — CID 160513135

IUPACN-(11,11-dimethylbenzo[a]fluoren-9-yl)-11,11-dimethyl-N-(4-methylphenyl)benzo[a]fluoren-9-amine;N-(11,11-dimethylbenzo[a]fluoren-9-yl)-11,11-dimethyl-N-phenylbenzo[a]fluoren-9-amine;11,11-dimethyl-N,N-bis(4-phenylphenyl)benzo[a]fluoren-9-amine;11,11-dimethyl-N-phenyl-N-(4-phenylphenyl)benzo[a]fluoren-9-amine
SMILESCC1(C)c2cc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccccc4)cc3)ccc2-c2ccc3ccccc3c21.CC1(C)c2cc(N(c3ccccc3)c3ccc(-c4ccccc4)cc3)ccc2-c2ccc3ccccc3c21.CC1(C)c2cc(N(c3ccccc3)c3ccc4c(c3)C(C)(C)c3c-4ccc4ccccc34)ccc2-c2ccc3ccccc3c21.Cc1ccc(N(c2ccc3c(c2)C(C)(C)c2c-3ccc3ccccc23)c2ccc3c(c2)C(C)(C)c2c-3ccc3ccccc23)cc1
InChIInChI=1S/C45H37N.C44H35N.C43H33N.C37H29N/c1-28-14-18-31(19-15-28)46(32-20-24-36-38-22-16-29-10-6-8-12-34(29)42(38)44(2,3)40(36)26-32)33-21-25-37-39-23-17-30-11-7-9-13-35(30)43(39)45(4,5)41(37)27-33;1-43(2)39-26-31(20-24-35(39)37-22-18-28-12-8-10-16-33(28)41(37)43)45(30-14-6-5-7-15-30)32-21-25-36-38-23-19-29-13-9-11-17-34(29)42(38)44(3,4)40(36)27-32;1-43(2)41-29-37(26-28-39(41)40-27-21-34-15-9-10-16-38(34)42(40)43)44(35-22-17-32(18-23-35)30-11-5-3-6-12-30)36-24-19-33(20-25-36)31-13-7-4-8-14-31;1-37(2)35-25-31(22-24-33(35)34-23-19-28-13-9-10-16-32(28)36(34)37)38(29-14-7-4-8-15-29)30-20-17-27(18-21-30)26-11-5-3-6-12-26/h6-27H,1-5H3;5-27H,1-4H3;3-29H,1-2H3;3-25H,1-2H3
InChIKeyQTHPLFDXSZVHGF-UHFFFAOYSA-N
MW2220.96 g/mol
LogP46.69
Rot. Bonds15

About N-(11,11-dimethylbenzo[a]fluoren-9-yl)-11,11-dimethyl-N-(4-methylphenyl)benzo[a]fluoren-9-amine;N-(11,11-dimethylbenzo[a]fluoren-9-yl)-11,11-dimethyl-N-phenylbenzo[a]fluoren-9-amine;11,11-dimethyl-N,N-bis(4-phenylphenyl)benzo[a]fluoren-9-amine;11,11-dimethyl-N-phenyl-N-(4-phenylphenyl)benzo[a]fluoren-9-amine

N-(11,11-dimethylbenzo[a]fluoren-9-yl)-11,11-dimethyl-N-(4-methylphenyl)benzo[a]fluoren-9-amine;N-(11,11-dimethylbenzo[a]fluoren-9-yl)-11,11-dimethyl-N-phenylbenzo[a]fluoren-9-amine;11,11-dimethyl-N,N-bis(4-phenylphenyl)benzo[a]fluoren-9-amine;11,11-dimethyl-N-phenyl-N-(4-phenylphenyl)benzo[a]fluoren-9-amine (PubChem CID 160513135) has the molecular formula C169H134N4 and a molecular weight of 2220.96 g/mol. Its IUPAC name is N-(11,11-dimethylbenzo[a]fluoren-9-yl)-11,11-dimethyl-N-(4-methylphenyl)benzo[a]fluoren-9-amine;N-(11,11-dimethylbenzo[a]fluoren-9-yl)-11,11-dimethyl-N-phenylbenzo[a]fluoren-9-amine;11,11-dimethyl-N,N-bis(4-phenylphenyl)benzo[a]fluoren-9-amine;11,11-dimethyl-N-phenyl-N-(4-phenylphenyl)benzo[a]fluoren-9-amine.

Molecular Properties

Compound NameN-(11,11-dimethylbenzo[a]fluoren-9-yl)-11,11-dimethyl-N-(4-methylphenyl)benzo[a]fluoren-9-amine;N-(11,11-dimethylbenzo[a]fluoren-9-yl)-11,11-dimethyl-N-phenylbenzo[a]fluoren-9-amine;11,11-dimethyl-N,N-bis(4-phenylphenyl)benzo[a]fluoren-9-amine;11,11-dimethyl-N-phenyl-N-(4-phenylphenyl)benzo[a]fluoren-9-amine
PubChem CID160513135
Molecular FormulaC169H134N4
Molecular Weight2220.96 g/mol
Exact Mass2219.06
IUPAC NameN-(11,11-dimethylbenzo[a]fluoren-9-yl)-11,11-dimethyl-N-(4-methylphenyl)benzo[a]fluoren-9-amine;N-(11,11-dimethylbenzo[a]fluoren-9-yl)-11,11-dimethyl-N-phenylbenzo[a]fluoren-9-amine;11,11-dimethyl-N,N-bis(4-phenylphenyl)benzo[a]fluoren-9-amine;11,11-dimethyl-N-phenyl-N-(4-phenylphenyl)benzo[a]fluoren-9-amine
SMILESCC1(C)c2cc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccccc4)cc3)ccc2-c2ccc3ccccc3c21.CC1(C)c2cc(N(c3ccccc3)c3ccc(-c4ccccc4)cc3)ccc2-c2ccc3ccccc3c21.CC1(C)c2cc(N(c3ccccc3)c3ccc4c(c3)C(C)(C)c3c-4ccc4ccccc34)ccc2-c2ccc3ccccc3c21.Cc1ccc(N(c2ccc3c(c2)C(C)(C)c2c-3ccc3ccccc23)c2ccc3c(c2)C(C)(C)c2c-3ccc3ccccc23)cc1
InChIInChI=1S/C45H37N.C44H35N.C43H33N.C37H29N/c1-28-14-18-31(19-15-28)46(32-20-24-36-38-22-16-29-10-6-8-12-34(29)42(38)44(2,3)40(36)26-32)33-21-25-37-39-23-17-30-11-7-9-13-35(30)43(39)45(4,5)41(37)27-33;1-43(2)39-26-31(20-24-35(39)37-22-18-28-12-8-10-16-33(28)41(37)43)45(30-14-6-5-7-15-30)32-21-25-36-38-23-19-29-13-9-11-17-34(29)42(38)44(3,4)40(36)27-32;1-43(2)41-29-37(26-28-39(41)40-27-21-34-15-9-10-16-38(34)42(40)43)44(35-22-17-32(18-23-35)30-11-5-3-6-12-30)36-24-19-33(20-25-36)31-13-7-4-8-14-31;1-37(2)35-25-31(22-24-33(35)34-23-19-28-13-9-10-16-32(28)36(34)37)38(29-14-7-4-8-15-29)30-20-17-27(18-21-30)26-11-5-3-6-12-26/h6-27H,1-5H3;5-27H,1-4H3;3-29H,1-2H3;3-25H,1-2H3
InChIKeyQTHPLFDXSZVHGF-UHFFFAOYSA-N
XLogP46.69
TPSA12.96 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds15
Heavy Atoms173
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002220.96
LogP ≤ 546.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze N-(11,11-dimethylbenzo[a]fluoren-9-yl)-11,11-dimethyl-N-(4-methylphenyl)benzo[a]fluoren-9-amine;N-(11,11-dimethylbenzo[a]fluoren-9-yl)-11,11-dimethyl-N-phenylbenzo[a]fluoren-9-amine;11,11-dimethyl-N,N-bis(4-phenylphenyl)benzo[a]fluoren-9-amine;11,11-dimethyl-N-phenyl-N-(4-phenylphenyl)benzo[a]fluoren-9-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-(11,11-dimethylbenzo[a]fluoren-9-yl)-11,11-dimethyl-N-(4-methylphenyl)benzo[a]fluoren-9-amine;N-(11,11-dimethylbenzo[a]fluoren-9-yl)-11,11-dimethyl-N-phenylbenzo[a]fluoren-9-amine;11,11-dimethyl-N,N-bis(4-phenylphenyl)benzo[a]fluoren-9-amine;11,11-dimethyl-N-phenyl-N-(4-phenylphenyl)benzo[a]fluoren-9-amine?
The IUPAC name of N-(11,11-dimethylbenzo[a]fluoren-9-yl)-11,11-dimethyl-N-(4-methylphenyl)benzo[a]fluoren-9-amine;N-(11,11-dimethylbenzo[a]fluoren-9-yl)-11,11-dimethyl-N-phenylbenzo[a]fluoren-9-amine;11,11-dimethyl-N,N-bis(4-phenylphenyl)benzo[a]fluoren-9-amine;11,11-dimethyl-N-phenyl-N-(4-phenylphenyl)benzo[a]fluoren-9-amine (CID 160513135) is N-(11,11-dimethylbenzo[a]fluoren-9-yl)-11,11-dimethyl-N-(4-methylphenyl)benzo[a]fluoren-9-amine;N-(11,11-dimethylbenzo[a]fluoren-9-yl)-11,11-dimethyl-N-phenylbenzo[a]fluoren-9-amine;11,11-dimethyl-N,N-bis(4-phenylphenyl)benzo[a]fluoren-9-amine;11,11-dimethyl-N-phenyl-N-(4-phenylphenyl)benzo[a]fluoren-9-amine.
What is the SMILES notation for N-(11,11-dimethylbenzo[a]fluoren-9-yl)-11,11-dimethyl-N-(4-methylphenyl)benzo[a]fluoren-9-amine;N-(11,11-dimethylbenzo[a]fluoren-9-yl)-11,11-dimethyl-N-phenylbenzo[a]fluoren-9-amine;11,11-dimethyl-N,N-bis(4-phenylphenyl)benzo[a]fluoren-9-amine;11,11-dimethyl-N-phenyl-N-(4-phenylphenyl)benzo[a]fluoren-9-amine?
The canonical SMILES for N-(11,11-dimethylbenzo[a]fluoren-9-yl)-11,11-dimethyl-N-(4-methylphenyl)benzo[a]fluoren-9-amine;N-(11,11-dimethylbenzo[a]fluoren-9-yl)-11,11-dimethyl-N-phenylbenzo[a]fluoren-9-amine;11,11-dimethyl-N,N-bis(4-phenylphenyl)benzo[a]fluoren-9-amine;11,11-dimethyl-N-phenyl-N-(4-phenylphenyl)benzo[a]fluoren-9-amine is CC1(C)c2cc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccccc4)cc3)ccc2-c2ccc3ccccc3c21.CC1(C)c2cc(N(c3ccccc3)c3ccc(-c4ccccc4)cc3)ccc2-c2ccc3ccccc3c21.CC1(C)c2cc(N(c3ccccc3)c3ccc4c(c3)C(C)(C)c3c-4ccc4ccccc34)ccc2-c2ccc3ccccc3c21.Cc1ccc(N(c2ccc3c(c2)C(C)(C)c2c-3ccc3ccccc23)c2ccc3c(c2)C(C)(C)c2c-3ccc3ccccc23)cc1.
What is the InChIKey of N-(11,11-dimethylbenzo[a]fluoren-9-yl)-11,11-dimethyl-N-(4-methylphenyl)benzo[a]fluoren-9-amine;N-(11,11-dimethylbenzo[a]fluoren-9-yl)-11,11-dimethyl-N-phenylbenzo[a]fluoren-9-amine;11,11-dimethyl-N,N-bis(4-phenylphenyl)benzo[a]fluoren-9-amine;11,11-dimethyl-N-phenyl-N-(4-phenylphenyl)benzo[a]fluoren-9-amine?
The InChIKey is QTHPLFDXSZVHGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C45H37N.C44H35N.C43H33N.C37H29N/c1-28-14-18-31(19-15-28)46(32-20-24-36-38-22-16-29-10-6-8-12-34(29)42(38)44(2,3)40(36)26-32)33-21-25-37-39-23-17-30-11-7-9-13-35(30)43(39)45(4,5)41(37)27-33;1-43(2)39-26-31(20-24-35(39)37-22-18-28-12-8-10-16-33(28)41(37)43)45(30-14-6-5-7-15-30)32-21-25-36-38-23-19-29-13-9-11-17-34(29)42(38)44(3,4)40(36)27-32;1-43(2)41-29-37(26-28-39(41)40-27-21-34-15-9-10-16-38(34)42(40)43)44(35-22-17-32(18-23-35)30-11-5-3-6-12-30)36-24-19-33(20-25-36)31-13-7-4-8-14-31;1-37(2)35-25-31(22-24-33(35)34-23-19-28-13-9-10-16-32(28)36(34)37)38(29-14-7-4-8-15-29)30-20-17-27(18-21-30)26-11-5-3-6-12-26/h6-27H,1-5H3;5-27H,1-4H3;3-29H,1-2H3;3-25H,1-2H3.
What are the key properties of N-(11,11-dimethylbenzo[a]fluoren-9-yl)-11,11-dimethyl-N-(4-methylphenyl)benzo[a]fluoren-9-amine;N-(11,11-dimethylbenzo[a]fluoren-9-yl)-11,11-dimethyl-N-phenylbenzo[a]fluoren-9-amine;11,11-dimethyl-N,N-bis(4-phenylphenyl)benzo[a]fluoren-9-amine;11,11-dimethyl-N-phenyl-N-(4-phenylphenyl)benzo[a]fluoren-9-amine?
N-(11,11-dimethylbenzo[a]fluoren-9-yl)-11,11-dimethyl-N-(4-methylphenyl)benzo[a]fluoren-9-amine;N-(11,11-dimethylbenzo[a]fluoren-9-yl)-11,11-dimethyl-N-phenylbenzo[a]fluoren-9-amine;11,11-dimethyl-N,N-bis(4-phenylphenyl)benzo[a]fluoren-9-amine;11,11-dimethyl-N-phenyl-N-(4-phenylphenyl)benzo[a]fluoren-9-amine has a molecular weight of 2220.96 g/mol, XLogP of 46.69, 15 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(11,11-dimethylbenzo[a]fluoren-9-yl)-11,11-dimethyl-N-(4-methylphenyl)benzo[a]fluoren-9-amine;N-(11,11-dimethylbenzo[a]fluoren-9-yl)-11,11-dimethyl-N-phenylbenzo[a]fluoren-9-amine;11,11-dimethyl-N,N-bis(4-phenylphenyl)benzo[a]fluoren-9-amine;11,11-dimethyl-N-phenyl-N-(4-phenylphenyl)benzo[a]fluoren-9-amine is sourced from PubChem (CID 160513135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).