11,11-dimethyl-N,N-diphenylbenzo[a]fluoren-3-amine;11,11-dimethyl-N,N-diphenyl-2-[4-(N-phenylanilino)phenyl]benzo[b]fluoren-8-amine;11,11-dimethyl-N,N-diphenyl-8-[4-(N-phenylanilino)phenyl]benzo[b]fluoren-2-amine

C129H101N5 — CID 163735962

IUPAC11,11-dimethyl-N,N-diphenylbenzo[a]fluoren-3-amine;11,11-dimethyl-N,N-diphenyl-2-[4-(N-phenylanilino)phenyl]benzo[b]fluoren-8-amine;11,11-dimethyl-N,N-diphenyl-8-[4-(N-phenylanilino)phenyl]benzo[b]fluoren-2-amine
SMILESCC1(C)c2cc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)ccc2-c2cc3ccc(N(c4ccccc4)c4ccccc4)cc3cc21.CC1(C)c2cc(N(c3ccccc3)c3ccccc3)ccc2-c2cc3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)cc3cc21.CC1(C)c2ccccc2-c2ccc3cc(N(c4ccccc4)c4ccccc4)ccc3c21
InChIInChI=1S/2C49H38N2.C31H25N/c1-49(2)47-33-37(35-23-27-43(28-24-35)50(39-15-7-3-8-16-39)40-17-9-4-10-18-40)26-30-45(47)46-32-36-25-29-44(31-38(36)34-48(46)49)51(41-19-11-5-12-20-41)42-21-13-6-14-22-42;1-49(2)47-33-38-31-36(35-25-27-43(28-26-35)50(39-15-7-3-8-16-39)40-17-9-4-10-18-40)23-24-37(38)32-46(47)45-30-29-44(34-48(45)49)51(41-19-11-5-12-20-41)42-21-13-6-14-22-42;1-31(2)29-16-10-9-15-27(29)28-19-17-22-21-25(18-20-26(22)30(28)31)32(23-11-5-3-6-12-23)24-13-7-4-8-14-24/h2*3-34H,1-2H3;3-21H,1-2H3
InChIKeyLDPIZBJYSYCOSF-UHFFFAOYSA-N
MW1721.26 g/mol
LogP36.12
Rot. Bonds17

About 11,11-dimethyl-N,N-diphenylbenzo[a]fluoren-3-amine;11,11-dimethyl-N,N-diphenyl-2-[4-(N-phenylanilino)phenyl]benzo[b]fluoren-8-amine;11,11-dimethyl-N,N-diphenyl-8-[4-(N-phenylanilino)phenyl]benzo[b]fluoren-2-amine

11,11-dimethyl-N,N-diphenylbenzo[a]fluoren-3-amine;11,11-dimethyl-N,N-diphenyl-2-[4-(N-phenylanilino)phenyl]benzo[b]fluoren-8-amine;11,11-dimethyl-N,N-diphenyl-8-[4-(N-phenylanilino)phenyl]benzo[b]fluoren-2-amine (PubChem CID 163735962) has the molecular formula C129H101N5 and a molecular weight of 1721.26 g/mol. Its IUPAC name is 11,11-dimethyl-N,N-diphenylbenzo[a]fluoren-3-amine;11,11-dimethyl-N,N-diphenyl-2-[4-(N-phenylanilino)phenyl]benzo[b]fluoren-8-amine;11,11-dimethyl-N,N-diphenyl-8-[4-(N-phenylanilino)phenyl]benzo[b]fluoren-2-amine.

Molecular Properties

Compound Name11,11-dimethyl-N,N-diphenylbenzo[a]fluoren-3-amine;11,11-dimethyl-N,N-diphenyl-2-[4-(N-phenylanilino)phenyl]benzo[b]fluoren-8-amine;11,11-dimethyl-N,N-diphenyl-8-[4-(N-phenylanilino)phenyl]benzo[b]fluoren-2-amine
PubChem CID163735962
Molecular FormulaC129H101N5
Molecular Weight1721.26 g/mol
Exact Mass1719.81
IUPAC Name11,11-dimethyl-N,N-diphenylbenzo[a]fluoren-3-amine;11,11-dimethyl-N,N-diphenyl-2-[4-(N-phenylanilino)phenyl]benzo[b]fluoren-8-amine;11,11-dimethyl-N,N-diphenyl-8-[4-(N-phenylanilino)phenyl]benzo[b]fluoren-2-amine
SMILESCC1(C)c2cc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)ccc2-c2cc3ccc(N(c4ccccc4)c4ccccc4)cc3cc21.CC1(C)c2cc(N(c3ccccc3)c3ccccc3)ccc2-c2cc3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)cc3cc21.CC1(C)c2ccccc2-c2ccc3cc(N(c4ccccc4)c4ccccc4)ccc3c21
InChIInChI=1S/2C49H38N2.C31H25N/c1-49(2)47-33-37(35-23-27-43(28-24-35)50(39-15-7-3-8-16-39)40-17-9-4-10-18-40)26-30-45(47)46-32-36-25-29-44(31-38(36)34-48(46)49)51(41-19-11-5-12-20-41)42-21-13-6-14-22-42;1-49(2)47-33-38-31-36(35-25-27-43(28-26-35)50(39-15-7-3-8-16-39)40-17-9-4-10-18-40)23-24-37(38)32-46(47)45-30-29-44(34-48(45)49)51(41-19-11-5-12-20-41)42-21-13-6-14-22-42;1-31(2)29-16-10-9-15-27(29)28-19-17-22-21-25(18-20-26(22)30(28)31)32(23-11-5-3-6-12-23)24-13-7-4-8-14-24/h2*3-34H,1-2H3;3-21H,1-2H3
InChIKeyLDPIZBJYSYCOSF-UHFFFAOYSA-N
XLogP36.12
TPSA16.20 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds17
Heavy Atoms134
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001721.26
LogP ≤ 536.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 11,11-dimethyl-N,N-diphenylbenzo[a]fluoren-3-amine;11,11-dimethyl-N,N-diphenyl-2-[4-(N-phenylanilino)phenyl]benzo[b]fluoren-8-amine;11,11-dimethyl-N,N-diphenyl-8-[4-(N-phenylanilino)phenyl]benzo[b]fluoren-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(11,11-dimethylbenzo[a]fluoren-3-yl)-11,11-dimethyl-N-(4-phenylphenyl)benzo[b]fluoren-2-amine;N-(9,9-dimethylfluoren-2-yl)-11,11-dimethyl-N-(4-phenylphenyl)benzo[a]fluoren-3-amine;N-(9,9-dimethylfluoren-3-yl)-11,11-dimethyl-N-(4-phenylphenyl)benzo[a]fluoren-3-amine
CID 159039363
11,11-dimethyl-3-N,3-N,9-N,9-N-tetraphenylbenzo[a]fluorene-3,9-diamine;11,11-dimethyl-2-N,2-N,8-N,8-N-tetraphenylbenzo[b]fluorene-2,8-diamine
CID 160909742
11,11-dimethyl-N,N-diphenylbenzo[a]fluoren-3-amine;N,N-diphenyl-4-[2-[4-(N-phenylanilino)phenyl]spiro[benzo[b]fluorene-11,9'-fluorene]-8-yl]aniline;N,N-diphenyl-4-[8-[4-(N-phenylanilino)phenyl]spiro[benzo[b]fluorene-11,9'-fluorene]-2-yl]naphthalen-1-amine
CID 165033930
N-[4-(9,9-dimethylfluoren-3-yl)phenyl]-11,11-dimethyl-N-phenylbenzo[a]fluoren-9-amine
CID 170179875
11,11-dimethyl-N-phenyl-N-(4-phenylphenyl)benzo[b]fluoren-7-amine
CID 156554249
N-(9,9-dimethylfluoren-2-yl)-11,11-dimethyl-N-phenylbenzo[b]fluoren-7-amine
CID 156554324
9,9-dimethyl-N-[4-(6-pentacyclo[12.8.0.02,11.03,8.017,22]docosa-1(14),2(11),3(8),4,6,9,12,15,17,19,21-undecaenyl)phenyl]-N-(3-phenylphenyl)fluoren-2-amine
CID 177100656
9,9-dimethyl-2,7-dinaphthalen-2-ylfluorene;N-[4-[4-(N-(9,9-dimethylfluoren-2-yl)anilino)phenyl]phenyl]-9,9-dimethyl-N-phenylfluoren-2-amine;1,8-diphenylphenanthrene
CID 162212406
3-N-(9,9-dimethylfluoren-2-yl)-1-N-(10,10-dimethyl-17-pentacyclo[11.8.0.03,11.04,9.014,19]henicosa-1,3(11),4,6,8,12,14(19),15,17,20-decaenyl)-1-N,3-N-diphenylbenzene-1,3-diamine
CID 171052166
12,12-dimethyl-N-phenyl-N-(7,7,12,12-tetramethylindeno[2,1-g]fluoren-9-yl)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 130290640
16,16-dimethyl-N-phenyl-N-(4-phenylphenyl)hexacyclo[12.11.0.02,11.03,8.015,23.017,22]pentacosa-1(14),2(11),3(8),4,6,9,12,15(23),17,19,21,24-dodecaen-6-amine
CID 164721855
9,10-bis(9,9-dimethylfluoren-2-yl)-2-N,2-N,6-N,6-N-tetrakis(4-phenylphenyl)anthracene-2,6-diamine;9,10-bis(9,9-dimethylfluoren-2-yl)-2-N,2-N,6-N,6-N-tetraphenylanthracene-2,6-diamine;9,10-dinaphthalen-2-yl-2-N,6-N-diphenyl-2-N,6-N-bis(6,6,12,12-tetramethylindeno[1,2-b]fluoren-2-yl)anthracene-2,6-diamine
CID 159307663

Frequently Asked Questions

What is the IUPAC name of 11,11-dimethyl-N,N-diphenylbenzo[a]fluoren-3-amine;11,11-dimethyl-N,N-diphenyl-2-[4-(N-phenylanilino)phenyl]benzo[b]fluoren-8-amine;11,11-dimethyl-N,N-diphenyl-8-[4-(N-phenylanilino)phenyl]benzo[b]fluoren-2-amine?
The IUPAC name of 11,11-dimethyl-N,N-diphenylbenzo[a]fluoren-3-amine;11,11-dimethyl-N,N-diphenyl-2-[4-(N-phenylanilino)phenyl]benzo[b]fluoren-8-amine;11,11-dimethyl-N,N-diphenyl-8-[4-(N-phenylanilino)phenyl]benzo[b]fluoren-2-amine (CID 163735962) is 11,11-dimethyl-N,N-diphenylbenzo[a]fluoren-3-amine;11,11-dimethyl-N,N-diphenyl-2-[4-(N-phenylanilino)phenyl]benzo[b]fluoren-8-amine;11,11-dimethyl-N,N-diphenyl-8-[4-(N-phenylanilino)phenyl]benzo[b]fluoren-2-amine.
What is the SMILES notation for 11,11-dimethyl-N,N-diphenylbenzo[a]fluoren-3-amine;11,11-dimethyl-N,N-diphenyl-2-[4-(N-phenylanilino)phenyl]benzo[b]fluoren-8-amine;11,11-dimethyl-N,N-diphenyl-8-[4-(N-phenylanilino)phenyl]benzo[b]fluoren-2-amine?
The canonical SMILES for 11,11-dimethyl-N,N-diphenylbenzo[a]fluoren-3-amine;11,11-dimethyl-N,N-diphenyl-2-[4-(N-phenylanilino)phenyl]benzo[b]fluoren-8-amine;11,11-dimethyl-N,N-diphenyl-8-[4-(N-phenylanilino)phenyl]benzo[b]fluoren-2-amine is CC1(C)c2cc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)ccc2-c2cc3ccc(N(c4ccccc4)c4ccccc4)cc3cc21.CC1(C)c2cc(N(c3ccccc3)c3ccccc3)ccc2-c2cc3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)cc3cc21.CC1(C)c2ccccc2-c2ccc3cc(N(c4ccccc4)c4ccccc4)ccc3c21.
What is the InChIKey of 11,11-dimethyl-N,N-diphenylbenzo[a]fluoren-3-amine;11,11-dimethyl-N,N-diphenyl-2-[4-(N-phenylanilino)phenyl]benzo[b]fluoren-8-amine;11,11-dimethyl-N,N-diphenyl-8-[4-(N-phenylanilino)phenyl]benzo[b]fluoren-2-amine?
The InChIKey is LDPIZBJYSYCOSF-UHFFFAOYSA-N. The full InChI is InChI=1S/2C49H38N2.C31H25N/c1-49(2)47-33-37(35-23-27-43(28-24-35)50(39-15-7-3-8-16-39)40-17-9-4-10-18-40)26-30-45(47)46-32-36-25-29-44(31-38(36)34-48(46)49)51(41-19-11-5-12-20-41)42-21-13-6-14-22-42;1-49(2)47-33-38-31-36(35-25-27-43(28-26-35)50(39-15-7-3-8-16-39)40-17-9-4-10-18-40)23-24-37(38)32-46(47)45-30-29-44(34-48(45)49)51(41-19-11-5-12-20-41)42-21-13-6-14-22-42;1-31(2)29-16-10-9-15-27(29)28-19-17-22-21-25(18-20-26(22)30(28)31)32(23-11-5-3-6-12-23)24-13-7-4-8-14-24/h2*3-34H,1-2H3;3-21H,1-2H3.
What are the key properties of 11,11-dimethyl-N,N-diphenylbenzo[a]fluoren-3-amine;11,11-dimethyl-N,N-diphenyl-2-[4-(N-phenylanilino)phenyl]benzo[b]fluoren-8-amine;11,11-dimethyl-N,N-diphenyl-8-[4-(N-phenylanilino)phenyl]benzo[b]fluoren-2-amine?
11,11-dimethyl-N,N-diphenylbenzo[a]fluoren-3-amine;11,11-dimethyl-N,N-diphenyl-2-[4-(N-phenylanilino)phenyl]benzo[b]fluoren-8-amine;11,11-dimethyl-N,N-diphenyl-8-[4-(N-phenylanilino)phenyl]benzo[b]fluoren-2-amine has a molecular weight of 1721.26 g/mol, XLogP of 36.12, 17 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 11,11-dimethyl-N,N-diphenylbenzo[a]fluoren-3-amine;11,11-dimethyl-N,N-diphenyl-2-[4-(N-phenylanilino)phenyl]benzo[b]fluoren-8-amine;11,11-dimethyl-N,N-diphenyl-8-[4-(N-phenylanilino)phenyl]benzo[b]fluoren-2-amine is sourced from PubChem (CID 163735962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).