N-[4-(3-chlorophenyl)phenyl]-N-phenylnaphthalen-2-amine

C28H20ClN — CID 170223458

IUPACN-[4-(3-chlorophenyl)phenyl]-N-phenylnaphthalen-2-amine
SMILESClc1cccc(-c2ccc(N(c3ccccc3)c3ccc4ccccc4c3)cc2)c1
InChIInChI=1S/C28H20ClN/c29-25-10-6-9-23(19-25)22-13-16-27(17-14-22)30(26-11-2-1-3-12-26)28-18-15-21-7-4-5-8-24(21)20-28/h1-20H
InChIKeyHMQLKWUJUMWEKO-UHFFFAOYSA-N
MW405.93 g/mol
LogP8.63
Rot. Bonds4

About N-[4-(3-chlorophenyl)phenyl]-N-phenylnaphthalen-2-amine

N-[4-(3-chlorophenyl)phenyl]-N-phenylnaphthalen-2-amine (PubChem CID 170223458) has the molecular formula C28H20ClN and a molecular weight of 405.93 g/mol. Its IUPAC name is N-[4-(3-chlorophenyl)phenyl]-N-phenylnaphthalen-2-amine.

Molecular Properties

Compound NameN-[4-(3-chlorophenyl)phenyl]-N-phenylnaphthalen-2-amine
PubChem CID170223458
Molecular FormulaC28H20ClN
Molecular Weight405.93 g/mol
Exact Mass405.13
IUPAC NameN-[4-(3-chlorophenyl)phenyl]-N-phenylnaphthalen-2-amine
SMILESClc1cccc(-c2ccc(N(c3ccccc3)c3ccc4ccccc4c3)cc2)c1
InChIInChI=1S/C28H20ClN/c29-25-10-6-9-23(19-25)22-13-16-27(17-14-22)30(26-11-2-1-3-12-26)28-18-15-21-7-4-5-8-24(21)20-28/h1-20H
InChIKeyHMQLKWUJUMWEKO-UHFFFAOYSA-N
XLogP8.63
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500405.93
LogP ≤ 58.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-[4-[4-[3-(N-naphthalen-2-ylanilino)phenyl]phenyl]phenyl]-N-phenylnaphthalen-2-amine
CID 121327966
3-naphthalen-2-yl-N,N-bis(4-phenylphenyl)aniline
CID 167236634
N-[4-[3-[3-[4-(dinaphthalen-2-ylamino)phenyl]phenyl]phenyl]phenyl]-N-naphthalen-2-ylnaphthalen-2-amine
CID 121286442
N-[4-[4-[4-[4-(N-naphthalen-2-ylanilino)phenyl]phenyl]phenyl]phenyl]-N-phenylnaphthalen-2-amine
CID 58905935
N,N-bis[4-[4-[4-(N-phenylanilino)phenyl]phenyl]phenyl]naphthalen-2-amine;N,N-diphenyl-4-[4-(N-[4-[4-(N-[4-[4-(N-phenylanilino)phenyl]phenyl]anilino)phenyl]phenyl]anilino)phenyl]aniline
CID 160607838
N-[4-[4-[4-(N-naphthalen-2-yl-4-phenylanilino)phenyl]phenyl]phenyl]-N-(4-phenylphenyl)naphthalen-2-amine
CID 59029881
N-[4-[3-(3-naphthalen-2-ylphenyl)phenyl]phenyl]-3-phenyl-N-(3-phenylphenyl)aniline
CID 166565645
3-naphthalen-2-yl-N-[3-(3-phenylphenyl)phenyl]-N-[4-(4-phenylphenyl)phenyl]aniline
CID 167323928
N-phenyl-6-[4-(N-(4-phenylphenyl)anilino)phenyl]-N-[6-[4-(N-(4-phenylphenyl)anilino)phenyl]naphthalen-2-yl]naphthalen-2-amine
CID 59690791
2-N,6-N,6-N-triphenyl-2-N-(4-phenylphenyl)naphthalene-2,6-diamine
CID 166917050
N-phenyl-7-[4-(N-phenylanilino)phenyl]-N-(4-phenylphenyl)naphthalen-2-amine
CID 166916774
4-[3,5-bis[4-(N-phenylanilino)phenyl]phenyl]-N,N-diphenylaniline;4-N-naphthalen-2-yl-1-N,1-N-bis[4-(N-naphthalen-2-ylanilino)phenyl]-4-N-phenylbenzene-1,4-diamine
CID 161230794

Frequently Asked Questions

What is the IUPAC name of N-[4-(3-chlorophenyl)phenyl]-N-phenylnaphthalen-2-amine?
The IUPAC name of N-[4-(3-chlorophenyl)phenyl]-N-phenylnaphthalen-2-amine (CID 170223458) is N-[4-(3-chlorophenyl)phenyl]-N-phenylnaphthalen-2-amine.
What is the SMILES notation for N-[4-(3-chlorophenyl)phenyl]-N-phenylnaphthalen-2-amine?
The canonical SMILES for N-[4-(3-chlorophenyl)phenyl]-N-phenylnaphthalen-2-amine is Clc1cccc(-c2ccc(N(c3ccccc3)c3ccc4ccccc4c3)cc2)c1.
What is the InChIKey of N-[4-(3-chlorophenyl)phenyl]-N-phenylnaphthalen-2-amine?
The InChIKey is HMQLKWUJUMWEKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H20ClN/c29-25-10-6-9-23(19-25)22-13-16-27(17-14-22)30(26-11-2-1-3-12-26)28-18-15-21-7-4-5-8-24(21)20-28/h1-20H.
What are the key properties of N-[4-(3-chlorophenyl)phenyl]-N-phenylnaphthalen-2-amine?
N-[4-(3-chlorophenyl)phenyl]-N-phenylnaphthalen-2-amine has a molecular weight of 405.93 g/mol, XLogP of 8.63, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(3-chlorophenyl)phenyl]-N-phenylnaphthalen-2-amine is sourced from PubChem (CID 170223458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).