N,N,4-triphenylnaphthalen-2-amine

C28H21N — CID 138623110

IUPACN,N,4-triphenylnaphthalen-2-amine
SMILESc1ccc(-c2cc(N(c3ccccc3)c3ccccc3)cc3ccccc23)cc1
InChIInChI=1S/C28H21N/c1-4-12-22(13-5-1)28-21-26(20-23-14-10-11-19-27(23)28)29(24-15-6-2-7-16-24)25-17-8-3-9-18-25/h1-21H
InChIKeyYSUPIHUVKCDKQP-UHFFFAOYSA-N
MW371.48 g/mol
LogP7.98
Rot. Bonds4

About N,N,4-triphenylnaphthalen-2-amine

N,N,4-triphenylnaphthalen-2-amine (PubChem CID 138623110) has the molecular formula C28H21N and a molecular weight of 371.48 g/mol. Its IUPAC name is N,N,4-triphenylnaphthalen-2-amine.

Molecular Properties

Compound NameN,N,4-triphenylnaphthalen-2-amine
PubChem CID138623110
Molecular FormulaC28H21N
Molecular Weight371.48 g/mol
Exact Mass371.17
IUPAC NameN,N,4-triphenylnaphthalen-2-amine
SMILESc1ccc(-c2cc(N(c3ccccc3)c3ccccc3)cc3ccccc23)cc1
InChIInChI=1S/C28H21N/c1-4-12-22(13-5-1)28-21-26(20-23-14-10-11-19-27(23)28)29(24-15-6-2-7-16-24)25-17-8-3-9-18-25/h1-21H
InChIKeyYSUPIHUVKCDKQP-UHFFFAOYSA-N
XLogP7.98
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500371.48
LogP ≤ 57.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

4-naphthalen-1-yl-N-phenyl-N-[4-(4-phenylnaphthalen-1-yl)phenyl]naphthalen-2-amine
CID 166589751
N-phenyl-N-[4-[4-[4-(N-(4-phenylphenyl)anilino)phenyl]naphthalen-2-yl]phenyl]naphthalen-2-amine
CID 166917627
N-phenyl-N-[4-(4-phenylnaphthalen-2-yl)phenyl]-4-(3-phenylphenyl)aniline
CID 139352860
3-N,3-N,9-N,9-N,1-pentakis-phenylphenanthrene-3,9-diamine
CID 58370995
N-phenyl-4-(3-phenylnaphthalen-1-yl)-N-[4-(2,4,6-triphenylphenyl)phenyl]aniline
CID 156808683
3-phenanthren-9-yl-N-(3-phenanthren-9-ylphenyl)-N-phenylaniline
CID 142614567
1,4-diphenylbenzene;N-(4-naphthalen-1-ylphenyl)-4-[4-(N-(4-naphthalen-1-ylphenyl)anilino)phenyl]-N-phenylaniline;N-phenyl-N-[4-[4-(N-pyren-2-ylanilino)phenyl]phenyl]pyren-2-amine
CID 161293442
N-[3-(2-chrysen-6-ylphenyl)phenyl]-N-(4-phenanthren-9-ylphenyl)-4-phenylnaphthalen-2-amine
CID 170141437
3-naphthalen-1-yl-N-(3-phenanthren-9-ylphenyl)-N-phenylaniline
CID 166566666
4-[4-[4-(4-naphthalen-1-yl-N-(4-naphthalen-1-ylphenyl)anilino)phenyl]phenyl]-N,N-diphenylaniline;N-[4-[4-[4-(4-naphthalen-1-yl-N-(4-naphthalen-1-ylphenyl)anilino)phenyl]phenyl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;4-phenyl-N-(4-phenylphenyl)-N-[4-[4-[4-[4-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]anilino]phenyl]phenyl]phenyl]aniline
CID 159367730
N,N-diphenyl-4-[4-[11-[4-[4-(N-phenylanilino)phenyl]phenyl]chrysen-5-yl]phenyl]aniline
CID 59987791
N-(9,9-dimethylfluoren-2-yl)-9,9-dimethyl-N-(4-phenylnaphthalen-2-yl)fluoren-2-amine
CID 138623042

Frequently Asked Questions

What is the IUPAC name of N,N,4-triphenylnaphthalen-2-amine?
The IUPAC name of N,N,4-triphenylnaphthalen-2-amine (CID 138623110) is N,N,4-triphenylnaphthalen-2-amine.
What is the SMILES notation for N,N,4-triphenylnaphthalen-2-amine?
The canonical SMILES for N,N,4-triphenylnaphthalen-2-amine is c1ccc(-c2cc(N(c3ccccc3)c3ccccc3)cc3ccccc23)cc1.
What is the InChIKey of N,N,4-triphenylnaphthalen-2-amine?
The InChIKey is YSUPIHUVKCDKQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H21N/c1-4-12-22(13-5-1)28-21-26(20-23-14-10-11-19-27(23)28)29(24-15-6-2-7-16-24)25-17-8-3-9-18-25/h1-21H.
What are the key properties of N,N,4-triphenylnaphthalen-2-amine?
N,N,4-triphenylnaphthalen-2-amine has a molecular weight of 371.48 g/mol, XLogP of 7.98, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,4-triphenylnaphthalen-2-amine is sourced from PubChem (CID 138623110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).