N-dibenzofuran-2-yl-N-(9,9-dimethylfluoren-4-yl)naphtho[2,1-b][1]benzofuran-2-amine

C43H29NO2 — CID 170035232

IUPACN-dibenzofuran-2-yl-N-(9,9-dimethylfluoren-4-yl)naphtho[2,1-b][1]benzofuran-2-amine
SMILESCC1(C)c2ccccc2-c2c(N(c3ccc4oc5ccccc5c4c3)c3ccc4ccc5oc6ccccc6c5c4c3)cccc21
InChIInChI=1S/C43H29NO2/c1-43(2)34-13-6-3-11-30(34)42-35(43)14-9-15-36(42)44(28-21-23-39-33(25-28)29-10-4-7-16-37(29)45-39)27-20-18-26-19-22-40-41(32(26)24-27)31-12-5-8-17-38(31)46-40/h3-25H,1-2H3
InChIKeyWBRVJLFOFKNFJF-UHFFFAOYSA-N
MW591.71 g/mol
LogP12.41
Rot. Bonds3

About N-dibenzofuran-2-yl-N-(9,9-dimethylfluoren-4-yl)naphtho[2,1-b][1]benzofuran-2-amine

N-dibenzofuran-2-yl-N-(9,9-dimethylfluoren-4-yl)naphtho[2,1-b][1]benzofuran-2-amine (PubChem CID 170035232) has the molecular formula C43H29NO2 and a molecular weight of 591.71 g/mol. Its IUPAC name is N-dibenzofuran-2-yl-N-(9,9-dimethylfluoren-4-yl)naphtho[2,1-b][1]benzofuran-2-amine.

Molecular Properties

Compound NameN-dibenzofuran-2-yl-N-(9,9-dimethylfluoren-4-yl)naphtho[2,1-b][1]benzofuran-2-amine
PubChem CID170035232
Molecular FormulaC43H29NO2
Molecular Weight591.71 g/mol
Exact Mass591.22
IUPAC NameN-dibenzofuran-2-yl-N-(9,9-dimethylfluoren-4-yl)naphtho[2,1-b][1]benzofuran-2-amine
SMILESCC1(C)c2ccccc2-c2c(N(c3ccc4oc5ccccc5c4c3)c3ccc4ccc5oc6ccccc6c5c4c3)cccc21
InChIInChI=1S/C43H29NO2/c1-43(2)34-13-6-3-11-30(34)42-35(43)14-9-15-36(42)44(28-21-23-39-33(25-28)29-10-4-7-16-37(29)45-39)27-20-18-26-19-22-40-41(32(26)24-27)31-12-5-8-17-38(31)46-40/h3-25H,1-2H3
InChIKeyWBRVJLFOFKNFJF-UHFFFAOYSA-N
XLogP12.41
TPSA29.52 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms46
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500591.71
LogP ≤ 512.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-chrysen-4-yl-N-(9,9-dimethylfluoren-4-yl)dibenzofuran-2-amine
CID 170140218
N-(9,9-dimethylfluoren-4-yl)-N-phenyldibenzofuran-2-amine
CID 164829370
N-(9,9-dimethylfluoren-4-yl)-N-[2-[2-(2-phenylphenyl)phenyl]phenyl]dibenzofuran-2-amine
CID 170119768
9,9-dimethyl-N-(4-naphtho[2,1-b][1]benzofuran-2-ylphenyl)-N-(3-phenylphenyl)fluoren-4-amine
CID 170035242
[4-[dibenzofuran-2-yl-[22-[dibenzofuran-2-yl-(9,9-dimethylfluoren-4-yl)amino]-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-dodecaen-8-yl]amino]-9-methylfluoren-9-yl]methanethiol
CID 170236511
N-chrysen-6-yl-N-(9,9-dimethylfluoren-4-yl)dibenzofuran-3-amine
CID 170139265
3-N-dibenzofuran-1-yl-1-N-dibenzofuran-2-yl-1-N-(9,9-dimethylfluoren-4-yl)-3-N-(9,9-diphenylfluoren-4-yl)benzene-1,3-diamine
CID 147414987
N-(3-dibenzofuran-2-ylphenyl)-9,9-dimethyl-N-(4-naphthalen-1-ylphenyl)fluoren-4-amine
CID 170535038
N-(2-dibenzofuran-4-ylphenyl)-N-[2-(9,9-dimethylfluoren-4-yl)phenyl]dibenzofuran-2-amine
CID 170139193
N-[2-(9,9-dimethylfluoren-4-yl)phenyl]-N-(3,4-diphenylphenyl)dibenzofuran-2-amine
CID 170192619
N-(2-dibenzofuran-1-ylphenyl)-N-(9,9-dimethylfluoren-4-yl)-9,9-dimethylfluoren-4-amine
CID 139568033
N-(9,9-dimethylfluoren-4-yl)-9,9-dimethyl-N-(4-naphtho[2,1-b][1]benzofuran-5-ylphenyl)fluoren-4-amine
CID 170036685

Frequently Asked Questions

What is the IUPAC name of N-dibenzofuran-2-yl-N-(9,9-dimethylfluoren-4-yl)naphtho[2,1-b][1]benzofuran-2-amine?
The IUPAC name of N-dibenzofuran-2-yl-N-(9,9-dimethylfluoren-4-yl)naphtho[2,1-b][1]benzofuran-2-amine (CID 170035232) is N-dibenzofuran-2-yl-N-(9,9-dimethylfluoren-4-yl)naphtho[2,1-b][1]benzofuran-2-amine.
What is the SMILES notation for N-dibenzofuran-2-yl-N-(9,9-dimethylfluoren-4-yl)naphtho[2,1-b][1]benzofuran-2-amine?
The canonical SMILES for N-dibenzofuran-2-yl-N-(9,9-dimethylfluoren-4-yl)naphtho[2,1-b][1]benzofuran-2-amine is CC1(C)c2ccccc2-c2c(N(c3ccc4oc5ccccc5c4c3)c3ccc4ccc5oc6ccccc6c5c4c3)cccc21.
What is the InChIKey of N-dibenzofuran-2-yl-N-(9,9-dimethylfluoren-4-yl)naphtho[2,1-b][1]benzofuran-2-amine?
The InChIKey is WBRVJLFOFKNFJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C43H29NO2/c1-43(2)34-13-6-3-11-30(34)42-35(43)14-9-15-36(42)44(28-21-23-39-33(25-28)29-10-4-7-16-37(29)45-39)27-20-18-26-19-22-40-41(32(26)24-27)31-12-5-8-17-38(31)46-40/h3-25H,1-2H3.
What are the key properties of N-dibenzofuran-2-yl-N-(9,9-dimethylfluoren-4-yl)naphtho[2,1-b][1]benzofuran-2-amine?
N-dibenzofuran-2-yl-N-(9,9-dimethylfluoren-4-yl)naphtho[2,1-b][1]benzofuran-2-amine has a molecular weight of 591.71 g/mol, XLogP of 12.41, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-dibenzofuran-2-yl-N-(9,9-dimethylfluoren-4-yl)naphtho[2,1-b][1]benzofuran-2-amine is sourced from PubChem (CID 170035232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).