N,N-bis(7,7-dimethylbenzo[g]fluoren-9-yl)-7,7-dimethylbenzo[g]fluoren-9-amine

C57H45N — CID 90272762

IUPACN,N-bis(7,7-dimethylbenzo[g]fluoren-9-yl)-7,7-dimethylbenzo[g]fluoren-9-amine
SMILESCC1(C)c2cc(N(c3ccc4c(c3)C(C)(C)c3ccc5ccccc5c3-4)c3ccc4c(c3)C(C)(C)c3ccc5ccccc5c3-4)ccc2-c2c1ccc1ccccc21
InChIInChI=1S/C57H45N/c1-55(2)46-28-19-34-13-7-10-16-40(34)52(46)43-25-22-37(31-49(43)55)58(38-23-26-44-50(32-38)56(3,4)47-29-20-35-14-8-11-17-41(35)53(44)47)39-24-27-45-51(33-39)57(5,6)48-30-21-36-15-9-12-18-42(36)54(45)48/h7-33H,1-6H3
InChIKeyDHYVPTWNDDEJOU-UHFFFAOYSA-N
MW743.99 g/mol
LogP15.53
Rot. Bonds3

About N,N-bis(7,7-dimethylbenzo[g]fluoren-9-yl)-7,7-dimethylbenzo[g]fluoren-9-amine

N,N-bis(7,7-dimethylbenzo[g]fluoren-9-yl)-7,7-dimethylbenzo[g]fluoren-9-amine (PubChem CID 90272762) has the molecular formula C57H45N and a molecular weight of 743.99 g/mol. Its IUPAC name is N,N-bis(7,7-dimethylbenzo[g]fluoren-9-yl)-7,7-dimethylbenzo[g]fluoren-9-amine.

Molecular Properties

Compound NameN,N-bis(7,7-dimethylbenzo[g]fluoren-9-yl)-7,7-dimethylbenzo[g]fluoren-9-amine
PubChem CID90272762
Molecular FormulaC57H45N
Molecular Weight743.99 g/mol
Exact Mass743.36
IUPAC NameN,N-bis(7,7-dimethylbenzo[g]fluoren-9-yl)-7,7-dimethylbenzo[g]fluoren-9-amine
SMILESCC1(C)c2cc(N(c3ccc4c(c3)C(C)(C)c3ccc5ccccc5c3-4)c3ccc4c(c3)C(C)(C)c3ccc5ccccc5c3-4)ccc2-c2c1ccc1ccccc21
InChIInChI=1S/C57H45N/c1-55(2)46-28-19-34-13-7-10-16-40(34)52(46)43-25-22-37(31-49(43)55)58(38-23-26-44-50(32-38)56(3,4)47-29-20-35-14-8-11-17-41(35)53(44)47)39-24-27-45-51(33-39)57(5,6)48-30-21-36-15-9-12-18-42(36)54(45)48/h7-33H,1-6H3
InChIKeyDHYVPTWNDDEJOU-UHFFFAOYSA-N
XLogP15.53
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms58
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500743.99
LogP ≤ 515.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-(9,9-dimethylfluoren-2-yl)-7,7-dimethyl-N-(4-methylphenyl)benzo[g]fluoren-9-amine
CID 164794440
7,7-dimethyl-N-[4-(4-methylphenyl)phenyl]-N-phenylbenzo[g]fluoren-9-amine
CID 143561123
N-(7,7-dimethylbenzo[g]fluoren-9-yl)-N-(3,5-dimethylphenyl)-12,12-dimethylpentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2(11),3,5,7,9,13,15,17,19-decaen-7-amine
CID 130290624
N-(9,9-dimethylfluoren-2-yl)-7,7-dimethyl-N-(3-naphthalen-1-ylphenyl)benzo[g]fluoren-9-amine
CID 166974898
N-[4-[4-(7,7-dimethylbenzo[g]fluoren-9-yl)phenyl]phenyl]-N,4-diphenylaniline
CID 130250677
8-N,22-N-bis(7,7-dimethylbenzo[g]fluoren-9-yl)-8-N,22-N-diphenyl-5,15,25-trioxaheptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19(24),20,22,26-dodecaene-8,22-diamine
CID 159152626
N-(9,9-dimethylfluoren-2-yl)-N-phenylspiro[benzo[g]fluorene-7,9'-fluorene]-9-amine
CID 134193943
N-(12,12-dimethyl-17-pentacyclo[11.8.0.02,11.03,8.015,20]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaenyl)-12,12,22,22-tetramethyl-N-phenylhexacyclo[11.11.0.02,11.03,8.015,23.016,21]tetracosa-1(13),2(11),3,5,7,9,14,16(21),17,19,23-undecaen-19-amine
CID 130290138
N-(7,7-dimethylbenzo[g]fluoren-9-yl)-12,12-dimethyl-N-(3-phenylphenyl)pentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2(11),3,5,7,9,13,15,17,19-decaen-7-amine
CID 130290737
12,12,22,22-tetramethyl-N-phenanthren-3-yl-N-(4-phenylphenyl)hexacyclo[11.11.0.02,11.03,8.015,23.016,21]tetracosa-1(13),2(11),3,5,7,9,14,16(21),17,19,23-undecaen-19-amine
CID 118122815
7,7-dimethyl-N-[4-(1-methyl-2,4,5-triphenylpyrrol-3-yl)phenyl]-N-(4-phenylphenyl)benzo[g]fluoren-9-amine
CID 121450573
7,7-dimethylbenzo[g]fluoren-9-amine
CID 90277897

Frequently Asked Questions

What is the IUPAC name of N,N-bis(7,7-dimethylbenzo[g]fluoren-9-yl)-7,7-dimethylbenzo[g]fluoren-9-amine?
The IUPAC name of N,N-bis(7,7-dimethylbenzo[g]fluoren-9-yl)-7,7-dimethylbenzo[g]fluoren-9-amine (CID 90272762) is N,N-bis(7,7-dimethylbenzo[g]fluoren-9-yl)-7,7-dimethylbenzo[g]fluoren-9-amine.
What is the SMILES notation for N,N-bis(7,7-dimethylbenzo[g]fluoren-9-yl)-7,7-dimethylbenzo[g]fluoren-9-amine?
The canonical SMILES for N,N-bis(7,7-dimethylbenzo[g]fluoren-9-yl)-7,7-dimethylbenzo[g]fluoren-9-amine is CC1(C)c2cc(N(c3ccc4c(c3)C(C)(C)c3ccc5ccccc5c3-4)c3ccc4c(c3)C(C)(C)c3ccc5ccccc5c3-4)ccc2-c2c1ccc1ccccc21.
What is the InChIKey of N,N-bis(7,7-dimethylbenzo[g]fluoren-9-yl)-7,7-dimethylbenzo[g]fluoren-9-amine?
The InChIKey is DHYVPTWNDDEJOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C57H45N/c1-55(2)46-28-19-34-13-7-10-16-40(34)52(46)43-25-22-37(31-49(43)55)58(38-23-26-44-50(32-38)56(3,4)47-29-20-35-14-8-11-17-41(35)53(44)47)39-24-27-45-51(33-39)57(5,6)48-30-21-36-15-9-12-18-42(36)54(45)48/h7-33H,1-6H3.
What are the key properties of N,N-bis(7,7-dimethylbenzo[g]fluoren-9-yl)-7,7-dimethylbenzo[g]fluoren-9-amine?
N,N-bis(7,7-dimethylbenzo[g]fluoren-9-yl)-7,7-dimethylbenzo[g]fluoren-9-amine has a molecular weight of 743.99 g/mol, XLogP of 15.53, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis(7,7-dimethylbenzo[g]fluoren-9-yl)-7,7-dimethylbenzo[g]fluoren-9-amine is sourced from PubChem (CID 90272762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).