N-(4-cyclohexa-1,5-dien-1-ylphenyl)naphthalen-2-amine

C22H19N — CID 146594518

IUPACN-(4-cyclohexa-1,5-dien-1-ylphenyl)naphthalen-2-amine
SMILESC1=CC(c2ccc(Nc3ccc4ccccc4c3)cc2)=CCC1
InChIInChI=1S/C22H19N/c1-2-6-17(7-3-1)19-10-13-21(14-11-19)23-22-15-12-18-8-4-5-9-20(18)16-22/h2,4-16,23H,1,3H2
InChIKeyFTBLNPXTROZHRC-UHFFFAOYSA-N
MW297.40 g/mol
LogP6.32
Rot. Bonds3

About N-(4-cyclohexa-1,5-dien-1-ylphenyl)naphthalen-2-amine

N-(4-cyclohexa-1,5-dien-1-ylphenyl)naphthalen-2-amine (PubChem CID 146594518) has the molecular formula C22H19N and a molecular weight of 297.40 g/mol. Its IUPAC name is N-(4-cyclohexa-1,5-dien-1-ylphenyl)naphthalen-2-amine.

Molecular Properties

Compound NameN-(4-cyclohexa-1,5-dien-1-ylphenyl)naphthalen-2-amine
PubChem CID146594518
Molecular FormulaC22H19N
Molecular Weight297.40 g/mol
Exact Mass297.15
IUPAC NameN-(4-cyclohexa-1,5-dien-1-ylphenyl)naphthalen-2-amine
SMILESC1=CC(c2ccc(Nc3ccc4ccccc4c3)cc2)=CCC1
InChIInChI=1S/C22H19N/c1-2-6-17(7-3-1)19-10-13-21(14-11-19)23-22-15-12-18-8-4-5-9-20(18)16-22/h2,4-16,23H,1,3H2
InChIKeyFTBLNPXTROZHRC-UHFFFAOYSA-N
XLogP6.32
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500297.40
LogP ≤ 56.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-cyclohexa-1,5-dien-1-ylnaphthalene;ethane
CID 144938588
N-(4-cyclohexa-1,5-dien-1-ylphenyl)naphthalen-1-amine
CID 167190987
1-N,4-N-dinaphthalen-2-ylbenzene-1,4-diamine
CID 7142
4-cyclohexa-1,5-dien-1-yl-N-[4-[2-methyl-3-(2-methylphenyl)phenyl]phenyl]aniline
CID 134228987
cyclohexa-1,5-dien-1-ylbenzene;methane
CID 156791104
N-(7,8-dihydronaphthalen-2-yl)naphthalen-2-amine
CID 172758843
N-(4-cyclohexa-1,5-dien-1-ylphenyl)-3-(9-phenylcarbazol-4-yl)aniline
CID 167195742
N-pentacen-2-ylpentacen-2-amine
CID 91227915
2-N,6-N-diphenylnaphthalene-2,6-diamine
CID 12541294
6-[7-(4-bromophenyl)naphthalen-2-yl]-N-(4-naphthalen-2-ylphenyl)naphthalen-2-amine
CID 156573110
N,6-diphenylnaphthalen-2-amine
CID 67205043
N-(4-cyclohexa-1,5-dien-1-ylphenyl)methanesulfonamide
CID 129312965

Frequently Asked Questions

What is the IUPAC name of N-(4-cyclohexa-1,5-dien-1-ylphenyl)naphthalen-2-amine?
The IUPAC name of N-(4-cyclohexa-1,5-dien-1-ylphenyl)naphthalen-2-amine (CID 146594518) is N-(4-cyclohexa-1,5-dien-1-ylphenyl)naphthalen-2-amine.
What is the SMILES notation for N-(4-cyclohexa-1,5-dien-1-ylphenyl)naphthalen-2-amine?
The canonical SMILES for N-(4-cyclohexa-1,5-dien-1-ylphenyl)naphthalen-2-amine is C1=CC(c2ccc(Nc3ccc4ccccc4c3)cc2)=CCC1.
What is the InChIKey of N-(4-cyclohexa-1,5-dien-1-ylphenyl)naphthalen-2-amine?
The InChIKey is FTBLNPXTROZHRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19N/c1-2-6-17(7-3-1)19-10-13-21(14-11-19)23-22-15-12-18-8-4-5-9-20(18)16-22/h2,4-16,23H,1,3H2.
What are the key properties of N-(4-cyclohexa-1,5-dien-1-ylphenyl)naphthalen-2-amine?
N-(4-cyclohexa-1,5-dien-1-ylphenyl)naphthalen-2-amine has a molecular weight of 297.40 g/mol, XLogP of 6.32, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-cyclohexa-1,5-dien-1-ylphenyl)naphthalen-2-amine is sourced from PubChem (CID 146594518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).