N-phenyl-N-(2-phenylphenyl)-1,2-dihydroacenaphthylen-3-amine

C30H23N — CID 22630556

IUPACN-phenyl-N-(2-phenylphenyl)-1,2-dihydroacenaphthylen-3-amine
SMILESc1ccc(-c2ccccc2N(c2ccccc2)c2ccc3cccc4c3c2CC4)cc1
InChIInChI=1S/C30H23N/c1-3-10-22(11-4-1)26-16-7-8-17-28(26)31(25-14-5-2-6-15-25)29-21-19-24-13-9-12-23-18-20-27(29)30(23)24/h1-17,19,21H,18,20H2
InChIKeyVCKILGHOSVMDPW-UHFFFAOYSA-N
MW397.52 g/mol
LogP8.08
Rot. Bonds4

About N-phenyl-N-(2-phenylphenyl)-1,2-dihydroacenaphthylen-3-amine

N-phenyl-N-(2-phenylphenyl)-1,2-dihydroacenaphthylen-3-amine (PubChem CID 22630556) has the molecular formula C30H23N and a molecular weight of 397.52 g/mol. Its IUPAC name is N-phenyl-N-(2-phenylphenyl)-1,2-dihydroacenaphthylen-3-amine.

Molecular Properties

Compound NameN-phenyl-N-(2-phenylphenyl)-1,2-dihydroacenaphthylen-3-amine
PubChem CID22630556
Molecular FormulaC30H23N
Molecular Weight397.52 g/mol
Exact Mass397.18
IUPAC NameN-phenyl-N-(2-phenylphenyl)-1,2-dihydroacenaphthylen-3-amine
SMILESc1ccc(-c2ccccc2N(c2ccccc2)c2ccc3cccc4c3c2CC4)cc1
InChIInChI=1S/C30H23N/c1-3-10-22(11-4-1)26-16-7-8-17-28(26)31(25-14-5-2-6-15-25)29-21-19-24-13-9-12-23-18-20-27(29)30(23)24/h1-17,19,21H,18,20H2
InChIKeyVCKILGHOSVMDPW-UHFFFAOYSA-N
XLogP8.08
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500397.52
LogP ≤ 58.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-[4-[4-(N-anthracen-9-ylanilino)phenyl]phenyl]-N-phenylanthracen-9-amine;N-[4-[4-[N-(1,2-dihydroacenaphthylen-3-yl)anilino]phenyl]phenyl]-N-phenyl-1,2-dihydroacenaphthylen-3-amine;1-N,5-N-dinaphthalen-1-yl-1-N,5-N-diphenylnaphthalene-1,5-diamine
CID 160642479
N-(2-phenylphenyl)-N,8-bis(4-phenylphenyl)naphthalen-1-amine
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CID 166866292
1-naphthalen-1-yl-N-phenyl-N-(2-phenylphenyl)naphthalen-2-amine
CID 164774553
N-(4-tert-butylphenyl)-2-phenyl-N-[2-(8-phenylnaphthalen-1-yl)phenyl]aniline
CID 170288466
N-(9H-fluoren-1-yl)-N-(4-phenylphenyl)chrysen-1-amine
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N-[4-(4-chrysen-6-ylphenyl)phenyl]-N-phenyl-2-(4-phenylphenyl)aniline
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N-phenyl-N-(2-phenylphenyl)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-tetradecaen-4-amine
CID 167412210
2-benzo[c]phenanthren-2-yl-4-phenyl-N-(2-phenylphenyl)-N-(4-phenylphenyl)aniline
CID 167183799
N-[2-(8-phenylnaphthalen-1-yl)phenyl]-N-(4-phenylphenyl)-2-[2-(2-phenylphenyl)phenyl]aniline
CID 170304738
2-N-phenyl-2-N-(2-phenylphenyl)benzene-1,2-diamine
CID 175803313
N,2-diphenyl-N-(2-phenylphenyl)-4-[3-phenyl-4-(N-(2-phenylphenyl)anilino)phenyl]aniline
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Frequently Asked Questions

What is the IUPAC name of N-phenyl-N-(2-phenylphenyl)-1,2-dihydroacenaphthylen-3-amine?
The IUPAC name of N-phenyl-N-(2-phenylphenyl)-1,2-dihydroacenaphthylen-3-amine (CID 22630556) is N-phenyl-N-(2-phenylphenyl)-1,2-dihydroacenaphthylen-3-amine.
What is the SMILES notation for N-phenyl-N-(2-phenylphenyl)-1,2-dihydroacenaphthylen-3-amine?
The canonical SMILES for N-phenyl-N-(2-phenylphenyl)-1,2-dihydroacenaphthylen-3-amine is c1ccc(-c2ccccc2N(c2ccccc2)c2ccc3cccc4c3c2CC4)cc1.
What is the InChIKey of N-phenyl-N-(2-phenylphenyl)-1,2-dihydroacenaphthylen-3-amine?
The InChIKey is VCKILGHOSVMDPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H23N/c1-3-10-22(11-4-1)26-16-7-8-17-28(26)31(25-14-5-2-6-15-25)29-21-19-24-13-9-12-23-18-20-27(29)30(23)24/h1-17,19,21H,18,20H2.
What are the key properties of N-phenyl-N-(2-phenylphenyl)-1,2-dihydroacenaphthylen-3-amine?
N-phenyl-N-(2-phenylphenyl)-1,2-dihydroacenaphthylen-3-amine has a molecular weight of 397.52 g/mol, XLogP of 8.08, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-phenyl-N-(2-phenylphenyl)-1,2-dihydroacenaphthylen-3-amine is sourced from PubChem (CID 22630556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).