7-bromo-N-naphthalen-1-yl-N,9-diphenylcarbazol-2-amine

C34H23BrN2 — CID 121328079

IUPAC7-bromo-N-naphthalen-1-yl-N,9-diphenylcarbazol-2-amine
SMILESBrc1ccc2c3ccc(N(c4ccccc4)c4cccc5ccccc45)cc3n(-c3ccccc3)c2c1
InChIInChI=1S/C34H23BrN2/c35-25-18-20-30-31-21-19-28(23-34(31)37(33(30)22-25)27-14-5-2-6-15-27)36(26-12-3-1-4-13-26)32-17-9-11-24-10-7-8-16-29(24)32/h1-23H
InChIKeyCBYLXUHLTANNRF-UHFFFAOYSA-N
MW539.48 g/mol
LogP10.17
Rot. Bonds4

About 7-bromo-N-naphthalen-1-yl-N,9-diphenylcarbazol-2-amine

7-bromo-N-naphthalen-1-yl-N,9-diphenylcarbazol-2-amine (PubChem CID 121328079) has the molecular formula C34H23BrN2 and a molecular weight of 539.48 g/mol. Its IUPAC name is 7-bromo-N-naphthalen-1-yl-N,9-diphenylcarbazol-2-amine.

Molecular Properties

Compound Name7-bromo-N-naphthalen-1-yl-N,9-diphenylcarbazol-2-amine
PubChem CID121328079
Molecular FormulaC34H23BrN2
Molecular Weight539.48 g/mol
Exact Mass538.10
IUPAC Name7-bromo-N-naphthalen-1-yl-N,9-diphenylcarbazol-2-amine
SMILESBrc1ccc2c3ccc(N(c4ccccc4)c4cccc5ccccc45)cc3n(-c3ccccc3)c2c1
InChIInChI=1S/C34H23BrN2/c35-25-18-20-30-31-21-19-28(23-34(31)37(33(30)22-25)27-14-5-2-6-15-27)36(26-12-3-1-4-13-26)32-17-9-11-24-10-7-8-16-29(24)32/h1-23H
InChIKeyCBYLXUHLTANNRF-UHFFFAOYSA-N
XLogP10.17
TPSA8.17 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms37
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500539.48
LogP ≤ 510.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-[4-[4-(2-carbazol-9-ylcarbazol-9-yl)phenyl]phenyl]-N-phenylnaphthalen-1-amine
CID 118152627
4-N-chrysen-1-yl-1-N,4-N-diphenyl-1-N-(9-phenylcarbazol-3-yl)benzene-1,4-diamine
CID 170410319
N-(4-heptacyclo[12.10.2.26,9.02,7.08,13.018,26.021,25]octacosa-1(24),2(7),3,5,8,10,12,14,16,18(26),19,21(25),22,27-tetradecaenyl)-N-naphthalen-1-yl-9-phenylcarbazol-2-amine
CID 167412869
CID 162446856
CID 162446856
N-naphthalen-1-yl-5,9-diphenyl-N-(4-phenylphenyl)carbazol-2-amine
CID 169009927
N-naphtho[1,2-b][1]benzofuran-7-yl-N,9-diphenylcarbazol-2-amine
CID 171738403
N-[3-(9,10-diphenylphenanthren-2-yl)phenyl]-N-naphthalen-1-yl-9-phenylcarbazol-2-amine
CID 169065210
1-N'-naphthalen-1-yl-1-N,1-N-diphenyl-1-N'-(9-phenylcarbazol-2-yl)-9,9'-spirobi[fluorene]-1,1'-diamine
CID 164838059
N-(3-naphthalen-1-ylnaphthalen-2-yl)-N,9-diphenylcarbazol-2-amine
CID 176588168
6-bromo-9-naphthalen-1-yl-N,N-diphenylcarbazol-2-amine;7-bromo-N-naphthalen-1-yl-N,9-diphenylcarbazol-2-amine;9-(4-bromophenyl)-N-(3,5-diphenylphenyl)-N-phenylphenanthren-3-amine
CID 162121806
N-naphthalen-1-yl-N-[4-(9-phenylcarbazol-2-yl)phenyl]dibenzoselenophen-3-amine
CID 162103702
1-N,7-N-diphenyl-1-N,7-N-bis(9-phenylcarbazol-3-yl)chrysene-1,7-diamine
CID 170410725

Frequently Asked Questions

What is the IUPAC name of 7-bromo-N-naphthalen-1-yl-N,9-diphenylcarbazol-2-amine?
The IUPAC name of 7-bromo-N-naphthalen-1-yl-N,9-diphenylcarbazol-2-amine (CID 121328079) is 7-bromo-N-naphthalen-1-yl-N,9-diphenylcarbazol-2-amine.
What is the SMILES notation for 7-bromo-N-naphthalen-1-yl-N,9-diphenylcarbazol-2-amine?
The canonical SMILES for 7-bromo-N-naphthalen-1-yl-N,9-diphenylcarbazol-2-amine is Brc1ccc2c3ccc(N(c4ccccc4)c4cccc5ccccc45)cc3n(-c3ccccc3)c2c1.
What is the InChIKey of 7-bromo-N-naphthalen-1-yl-N,9-diphenylcarbazol-2-amine?
The InChIKey is CBYLXUHLTANNRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H23BrN2/c35-25-18-20-30-31-21-19-28(23-34(31)37(33(30)22-25)27-14-5-2-6-15-27)36(26-12-3-1-4-13-26)32-17-9-11-24-10-7-8-16-29(24)32/h1-23H.
What are the key properties of 7-bromo-N-naphthalen-1-yl-N,9-diphenylcarbazol-2-amine?
7-bromo-N-naphthalen-1-yl-N,9-diphenylcarbazol-2-amine has a molecular weight of 539.48 g/mol, XLogP of 10.17, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-bromo-N-naphthalen-1-yl-N,9-diphenylcarbazol-2-amine is sourced from PubChem (CID 121328079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).