N-(3-bromo-5-carbazol-9-ylphenyl)-N-naphthalen-1-ylnaphthalen-1-amine

C38H25BrN2 — CID 144888357

IUPACN-(3-bromo-5-carbazol-9-ylphenyl)-N-naphthalen-1-ylnaphthalen-1-amine
SMILESBrc1cc(N(c2cccc3ccccc23)c2cccc3ccccc23)cc(-n2c3ccccc3c3ccccc32)c1
InChIInChI=1S/C38H25BrN2/c39-28-23-29(25-30(24-28)41-37-19-7-5-17-33(37)34-18-6-8-20-38(34)41)40(35-21-9-13-26-11-1-3-15-31(26)35)36-22-10-14-27-12-2-4-16-32(27)36/h1-25H
InChIKeyWRDFPQSGUHUBQF-UHFFFAOYSA-N
MW589.54 g/mol
LogP11.32
Rot. Bonds4

About N-(3-bromo-5-carbazol-9-ylphenyl)-N-naphthalen-1-ylnaphthalen-1-amine

N-(3-bromo-5-carbazol-9-ylphenyl)-N-naphthalen-1-ylnaphthalen-1-amine (PubChem CID 144888357) has the molecular formula C38H25BrN2 and a molecular weight of 589.54 g/mol. Its IUPAC name is N-(3-bromo-5-carbazol-9-ylphenyl)-N-naphthalen-1-ylnaphthalen-1-amine.

Molecular Properties

Compound NameN-(3-bromo-5-carbazol-9-ylphenyl)-N-naphthalen-1-ylnaphthalen-1-amine
PubChem CID144888357
Molecular FormulaC38H25BrN2
Molecular Weight589.54 g/mol
Exact Mass588.12
IUPAC NameN-(3-bromo-5-carbazol-9-ylphenyl)-N-naphthalen-1-ylnaphthalen-1-amine
SMILESBrc1cc(N(c2cccc3ccccc23)c2cccc3ccccc23)cc(-n2c3ccccc3c3ccccc32)c1
InChIInChI=1S/C38H25BrN2/c39-28-23-29(25-30(24-28)41-37-19-7-5-17-33(37)34-18-6-8-20-38(34)41)40(35-21-9-13-26-11-1-3-15-31(26)35)36-22-10-14-27-12-2-4-16-32(27)36/h1-25H
InChIKeyWRDFPQSGUHUBQF-UHFFFAOYSA-N
XLogP11.32
TPSA8.17 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms41
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500589.54
LogP ≤ 511.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-bromo-5-carbazol-9-ylphenyl)-N-(3-phenylphenyl)naphthalen-1-amine
CID 144888566
N-(3-bromo-5-carbazol-9-ylphenyl)-N-phenylnaphthalen-2-amine
CID 144888442
N-[3-bromo-5-(4-carbazol-9-ylphenyl)phenyl]-N-phenylnaphthalen-1-amine;prop-1-ene
CID 144888481
9-N,10-N-bis(4-carbazol-9-ylphenyl)-9-N,10-N-dinaphthalen-1-ylanthracene-9,10-diamine
CID 58273829
N-[3-[4-[9-[3,5-bis(4-phenylphenyl)phenyl]carbazol-3-yl]phenyl]phenyl]-N-naphthalen-1-ylnaphthalen-1-amine
CID 118087617
N-[3-carbazol-9-yl-5-(9-phenylcarbazol-1-yl)phenyl]-N-phenylnaphthalen-1-amine
CID 144888414
7-bromo-N-naphthalen-1-yl-N,9-diphenylcarbazol-2-amine
CID 121328079
N-(3-bromo-5-carbazol-9-ylphenyl)-N-naphthalen-2-yl-2,4-diphenylpyrimidin-5-amine
CID 144888468
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
N-[4-(3-carbazol-9-ylnaphthalen-1-yl)phenyl]-N-(4-phenylphenyl)naphthalen-1-amine
CID 168809283
N-naphthalen-1-yl-N-(3-pentacyclo[10.7.1.02,7.08,20.014,19]icosa-1(20),2(7),3,5,8,10,12,14,16,18-decaenyl)-9-phenylcarbazol-3-amine
CID 167357291
N-naphthalen-1-yl-N-(3-pentacyclo[10.7.1.02,7.08,20.014,19]icosa-1(20),2(7),3,5,8,10,12,14,16,18-decaenyl)-9-phenylcarbazol-2-amine
CID 167357271

Frequently Asked Questions

What is the IUPAC name of N-(3-bromo-5-carbazol-9-ylphenyl)-N-naphthalen-1-ylnaphthalen-1-amine?
The IUPAC name of N-(3-bromo-5-carbazol-9-ylphenyl)-N-naphthalen-1-ylnaphthalen-1-amine (CID 144888357) is N-(3-bromo-5-carbazol-9-ylphenyl)-N-naphthalen-1-ylnaphthalen-1-amine.
What is the SMILES notation for N-(3-bromo-5-carbazol-9-ylphenyl)-N-naphthalen-1-ylnaphthalen-1-amine?
The canonical SMILES for N-(3-bromo-5-carbazol-9-ylphenyl)-N-naphthalen-1-ylnaphthalen-1-amine is Brc1cc(N(c2cccc3ccccc23)c2cccc3ccccc23)cc(-n2c3ccccc3c3ccccc32)c1.
What is the InChIKey of N-(3-bromo-5-carbazol-9-ylphenyl)-N-naphthalen-1-ylnaphthalen-1-amine?
The InChIKey is WRDFPQSGUHUBQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C38H25BrN2/c39-28-23-29(25-30(24-28)41-37-19-7-5-17-33(37)34-18-6-8-20-38(34)41)40(35-21-9-13-26-11-1-3-15-31(26)35)36-22-10-14-27-12-2-4-16-32(27)36/h1-25H.
What are the key properties of N-(3-bromo-5-carbazol-9-ylphenyl)-N-naphthalen-1-ylnaphthalen-1-amine?
N-(3-bromo-5-carbazol-9-ylphenyl)-N-naphthalen-1-ylnaphthalen-1-amine has a molecular weight of 589.54 g/mol, XLogP of 11.32, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-bromo-5-carbazol-9-ylphenyl)-N-naphthalen-1-ylnaphthalen-1-amine is sourced from PubChem (CID 144888357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).