7,7-dimethyl-N,N-diphenylbenzo[c]fluoren-5-amine

C31H25N — CID 162712377

IUPAC7,7-dimethyl-N,N-diphenylbenzo[c]fluoren-5-amine
SMILESCC1(C)c2ccccc2-c2c1cc(N(c1ccccc1)c1ccccc1)c1ccccc21
InChIInChI=1S/C31H25N/c1-31(2)27-20-12-11-19-26(27)30-25-18-10-9-17-24(25)29(21-28(30)31)32(22-13-5-3-6-14-22)23-15-7-4-8-16-23/h3-21H,1-2H3
InChIKeyWTNMCKOVLFSBJS-UHFFFAOYSA-N
MW411.55 g/mol
LogP8.62
Rot. Bonds3

About 7,7-dimethyl-N,N-diphenylbenzo[c]fluoren-5-amine

7,7-dimethyl-N,N-diphenylbenzo[c]fluoren-5-amine (PubChem CID 162712377) has the molecular formula C31H25N and a molecular weight of 411.55 g/mol. Its IUPAC name is 7,7-dimethyl-N,N-diphenylbenzo[c]fluoren-5-amine.

Molecular Properties

Compound Name7,7-dimethyl-N,N-diphenylbenzo[c]fluoren-5-amine
PubChem CID162712377
Molecular FormulaC31H25N
Molecular Weight411.55 g/mol
Exact Mass411.20
IUPAC Name7,7-dimethyl-N,N-diphenylbenzo[c]fluoren-5-amine
SMILESCC1(C)c2ccccc2-c2c1cc(N(c1ccccc1)c1ccccc1)c1ccccc21
InChIInChI=1S/C31H25N/c1-31(2)27-20-12-11-19-26(27)30-25-18-10-9-17-24(25)29(21-28(30)31)32(22-13-5-3-6-14-22)23-15-7-4-8-16-23/h3-21H,1-2H3
InChIKeyWTNMCKOVLFSBJS-UHFFFAOYSA-N
XLogP8.62
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500411.55
LogP ≤ 58.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-(7,7-dimethylbenzo[c]fluoren-5-yl)-12,12-dimethyl-N-phenylpentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaen-9-amine
CID 130290172
N-[4-[4-(N-(7,7-dimethylbenzo[c]fluoren-5-yl)-4-methylanilino)phenyl]phenyl]-7,7-dimethyl-N-(4-methylphenyl)benzo[c]fluoren-5-amine;N-[4-[4-(N-(7,7-dimethylbenzo[c]fluoren-5-yl)-3-phenylanilino)phenyl]phenyl]-7,7-dimethyl-N-(3-phenylphenyl)benzo[c]fluoren-5-amine
CID 159608670
2-N'-(9,9-dimethylfluoren-2-yl)-2-N',5-N,5-N-triphenylspiro[benzo[c]fluorene-7,9'-fluorene]-2',5-diamine
CID 168775359
N-(7,7-dimethylbenzo[c]fluoren-5-yl)-N-phenyldibenzothiophen-4-amine
CID 90129132
11-N,11-N,25-N,25-N-tetraphenyl-14,14,28,28-tetrakis(trideuteriomethyl)heptacyclo[15.11.0.03,15.04,13.05,10.018,27.019,24]octacosa-1(17),2,4(13),5,7,9,11,15,18(27),19,21,23,25-tridecaene-11,25-diamine
CID 88848839
N,N,7-triphenyl-7-[7-phenyl-5-(N-phenylanilino)benzo[c]fluoren-7-yl]benzo[c]fluoren-5-amine
CID 134432446
7,7-dimethyl-5-N,5-N,9-N,9-N-tetrakis(4-phenylphenyl)benzo[c]fluorene-5,9-diamine
CID 162712053
7,7-dimethyl-N-phenanthren-2-yl-N-[4-(8-phenylnaphthalen-1-yl)phenyl]benzo[c]fluoren-5-amine
CID 169285163
12,12-dimethyl-N,N,15-tris(4-phenylphenyl)pentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaen-9-amine
CID 118428464
5-N,5-N,9-N,9-N-tetraphenylspiro[benzo[c]fluorene-7,9'-fluorene]-5,9-diamine
CID 59755274
9-N,9-N,19-N,19-N-tetrakis[4-[7-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]phenyl]-12,12,22,22-tetramethylhexacyclo[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-undecaene-9,19-diamine
CID 155323973
N-(9,9-dimethylfluoren-2-yl)-N-[4-(4-methylphenyl)phenyl]spiro[benzo[c]fluorene-7,9'-fluorene]-5-amine
CID 145144997

Frequently Asked Questions

What is the IUPAC name of 7,7-dimethyl-N,N-diphenylbenzo[c]fluoren-5-amine?
The IUPAC name of 7,7-dimethyl-N,N-diphenylbenzo[c]fluoren-5-amine (CID 162712377) is 7,7-dimethyl-N,N-diphenylbenzo[c]fluoren-5-amine.
What is the SMILES notation for 7,7-dimethyl-N,N-diphenylbenzo[c]fluoren-5-amine?
The canonical SMILES for 7,7-dimethyl-N,N-diphenylbenzo[c]fluoren-5-amine is CC1(C)c2ccccc2-c2c1cc(N(c1ccccc1)c1ccccc1)c1ccccc21.
What is the InChIKey of 7,7-dimethyl-N,N-diphenylbenzo[c]fluoren-5-amine?
The InChIKey is WTNMCKOVLFSBJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H25N/c1-31(2)27-20-12-11-19-26(27)30-25-18-10-9-17-24(25)29(21-28(30)31)32(22-13-5-3-6-14-22)23-15-7-4-8-16-23/h3-21H,1-2H3.
What are the key properties of 7,7-dimethyl-N,N-diphenylbenzo[c]fluoren-5-amine?
7,7-dimethyl-N,N-diphenylbenzo[c]fluoren-5-amine has a molecular weight of 411.55 g/mol, XLogP of 8.62, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7,7-dimethyl-N,N-diphenylbenzo[c]fluoren-5-amine is sourced from PubChem (CID 162712377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).