N-[4-(9-methylfluoren-9-yl)phenyl]-N-naphthalen-2-yl-9-phenylcarbazol-3-amine

C48H34N2 — CID 129293001

IUPACN-[4-(9-methylfluoren-9-yl)phenyl]-N-naphthalen-2-yl-9-phenylcarbazol-3-amine
SMILESCC1(c2ccc(N(c3ccc4ccccc4c3)c3ccc4c(c3)c3ccccc3n4-c3ccccc3)cc2)c2ccccc2-c2ccccc21
InChIInChI=1S/C48H34N2/c1-48(44-20-10-7-17-40(44)41-18-8-11-21-45(41)48)35-24-27-37(28-25-35)49(38-26-23-33-13-5-6-14-34(33)31-38)39-29-30-47-43(32-39)42-19-9-12-22-46(42)50(47)36-15-3-2-4-16-36/h2-32H,1H3
InChIKeyXOOSZJMHNQTEIM-UHFFFAOYSA-N
MW638.81 g/mol
LogP12.74
Rot. Bonds5

About N-[4-(9-methylfluoren-9-yl)phenyl]-N-naphthalen-2-yl-9-phenylcarbazol-3-amine

N-[4-(9-methylfluoren-9-yl)phenyl]-N-naphthalen-2-yl-9-phenylcarbazol-3-amine (PubChem CID 129293001) has the molecular formula C48H34N2 and a molecular weight of 638.81 g/mol. Its IUPAC name is N-[4-(9-methylfluoren-9-yl)phenyl]-N-naphthalen-2-yl-9-phenylcarbazol-3-amine.

Molecular Properties

Compound NameN-[4-(9-methylfluoren-9-yl)phenyl]-N-naphthalen-2-yl-9-phenylcarbazol-3-amine
PubChem CID129293001
Molecular FormulaC48H34N2
Molecular Weight638.81 g/mol
Exact Mass638.27
IUPAC NameN-[4-(9-methylfluoren-9-yl)phenyl]-N-naphthalen-2-yl-9-phenylcarbazol-3-amine
SMILESCC1(c2ccc(N(c3ccc4ccccc4c3)c3ccc4c(c3)c3ccccc3n4-c3ccccc3)cc2)c2ccccc2-c2ccccc21
InChIInChI=1S/C48H34N2/c1-48(44-20-10-7-17-40(44)41-18-8-11-21-45(41)48)35-24-27-37(28-25-35)49(38-26-23-33-13-5-6-14-34(33)31-38)39-29-30-47-43(32-39)42-19-9-12-22-46(42)50(47)36-15-3-2-4-16-36/h2-32H,1H3
InChIKeyXOOSZJMHNQTEIM-UHFFFAOYSA-N
XLogP12.74
TPSA8.17 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms50
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500638.81
LogP ≤ 512.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-naphthalen-2-yl-9,9-diphenyl-N-[9-phenyl-9-(9-phenylcarbazol-3-yl)fluoren-2-yl]fluoren-2-amine
CID 134452960
9-(4-fluorophenyl)-N-[4-(9-methylfluoren-9-yl)phenyl]-N-(4-phenylphenyl)carbazol-3-amine
CID 129293050
1-N-naphthalen-2-yl-3-N-[3-(N-naphthalen-2-ylanilino)phenyl]-1-N-phenyl-3-N-(9-phenylcarbazol-3-yl)benzene-1,3-diamine
CID 177275896
N-(4-carbazol-9-ylphenyl)-9,9-dimethyl-N-naphthalen-2-ylfluoren-2-amine
CID 58969347
N-[4-(9-methylfluoren-9-yl)phenyl]-N-[4-(9-phenylcarbazol-3-yl)phenyl]naphthalen-1-amine
CID 129293021
N-[4-[3,5-bis(9-phenylcarbazol-3-yl)phenyl]phenyl]-9,9-dimethyl-N-naphthalen-2-ylfluoren-2-amine
CID 118289290
N-[4-[2-(9-phenylcarbazol-3-yl)phenyl]phenyl]-N-(4-phenylphenyl)naphthalen-2-amine
CID 118103057
3-(9-methylfluoren-9-yl)-N-phenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]aniline
CID 129293023
N-(4-bromophenyl)-N-naphthalen-2-yl-9-phenylcarbazol-3-amine
CID 118632291
9-naphthalen-2-yl-N-phenyl-N-(9,9'-spirobi[fluorene]-2-yl)carbazol-3-amine
CID 59782759
N-(9,9-dimethylfluoren-2-yl)-9,9-dimethyl-N-[4-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]fluoren-2-amine;9,9-dimethyl-N-[4-[4-(9-naphthalen-2-ylcarbazol-3-yl)phenyl]phenyl]-N-(4-phenylphenyl)fluoren-2-amine;9,9-dimethyl-N-naphthalen-2-yl-N-[4-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]fluoren-2-amine
CID 161470218
N,N-bis(9,9-dimethylfluoren-3-yl)-9-phenylcarbazol-3-amine
CID 90261832

Frequently Asked Questions

What is the IUPAC name of N-[4-(9-methylfluoren-9-yl)phenyl]-N-naphthalen-2-yl-9-phenylcarbazol-3-amine?
The IUPAC name of N-[4-(9-methylfluoren-9-yl)phenyl]-N-naphthalen-2-yl-9-phenylcarbazol-3-amine (CID 129293001) is N-[4-(9-methylfluoren-9-yl)phenyl]-N-naphthalen-2-yl-9-phenylcarbazol-3-amine.
What is the SMILES notation for N-[4-(9-methylfluoren-9-yl)phenyl]-N-naphthalen-2-yl-9-phenylcarbazol-3-amine?
The canonical SMILES for N-[4-(9-methylfluoren-9-yl)phenyl]-N-naphthalen-2-yl-9-phenylcarbazol-3-amine is CC1(c2ccc(N(c3ccc4ccccc4c3)c3ccc4c(c3)c3ccccc3n4-c3ccccc3)cc2)c2ccccc2-c2ccccc21.
What is the InChIKey of N-[4-(9-methylfluoren-9-yl)phenyl]-N-naphthalen-2-yl-9-phenylcarbazol-3-amine?
The InChIKey is XOOSZJMHNQTEIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H34N2/c1-48(44-20-10-7-17-40(44)41-18-8-11-21-45(41)48)35-24-27-37(28-25-35)49(38-26-23-33-13-5-6-14-34(33)31-38)39-29-30-47-43(32-39)42-19-9-12-22-46(42)50(47)36-15-3-2-4-16-36/h2-32H,1H3.
What are the key properties of N-[4-(9-methylfluoren-9-yl)phenyl]-N-naphthalen-2-yl-9-phenylcarbazol-3-amine?
N-[4-(9-methylfluoren-9-yl)phenyl]-N-naphthalen-2-yl-9-phenylcarbazol-3-amine has a molecular weight of 638.81 g/mol, XLogP of 12.74, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(9-methylfluoren-9-yl)phenyl]-N-naphthalen-2-yl-9-phenylcarbazol-3-amine is sourced from PubChem (CID 129293001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).