N,N-diphenylaniline;10H-phenoxazine

C30H24N2O — CID 174810342

IUPACN,N-diphenylaniline;10H-phenoxazine
SMILESc1ccc(N(c2ccccc2)c2ccccc2)cc1.c1ccc2c(c1)Nc1ccccc1O2
InChIInChI=1S/C18H15N.C12H9NO/c1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-3-7-11-9(5-1)13-10-6-2-4-8-12(10)14-11/h1-15H;1-8,13H
InChIKeySBQHZNZQRKHMAN-UHFFFAOYSA-N
MW428.54 g/mol
LogP8.69
Rot. Bonds3

About N,N-diphenylaniline;10H-phenoxazine

N,N-diphenylaniline;10H-phenoxazine (PubChem CID 174810342) has the molecular formula C30H24N2O and a molecular weight of 428.54 g/mol. Its IUPAC name is N,N-diphenylaniline;10H-phenoxazine.

Molecular Properties

Compound NameN,N-diphenylaniline;10H-phenoxazine
PubChem CID174810342
Molecular FormulaC30H24N2O
Molecular Weight428.54 g/mol
Exact Mass428.19
IUPAC NameN,N-diphenylaniline;10H-phenoxazine
SMILESc1ccc(N(c2ccccc2)c2ccccc2)cc1.c1ccc2c(c1)Nc1ccccc1O2
InChIInChI=1S/C18H15N.C12H9NO/c1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-3-7-11-9(5-1)13-10-6-2-4-8-12(10)14-11/h1-15H;1-8,13H
InChIKeySBQHZNZQRKHMAN-UHFFFAOYSA-N
XLogP8.69
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500428.54
LogP ≤ 58.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-N,3-N,7-N,7-N-tetraphenyl-10H-phenoxazine-3,7-diamine
CID 118518276
10H-phenoxazine;thiophene 1,1-dioxide
CID 159670963
N,N-diphenylaniline;silane
CID 131739129
3-propyl-10H-phenoxazine
CID 140739556
14H-naphtho[2,3-b]phenoxazine
CID 141471429
10-deuteriophenoxazine
CID 138396006
acetylene;N,N-diphenylaniline
CID 162160270
N,N-diphenylaniline;ethene
CID 135186601
azane;N,N-diphenylaniline;methane
CID 174725062
1-phenyl-10H-phenoxazine;hydrobromide
CID 67531032
10H-phenoxazin-1-ylazanium
CID 163682705
tris(1,1'-biphenyl);N,N-diphenylaniline
CID 175290151

Frequently Asked Questions

What is the IUPAC name of N,N-diphenylaniline;10H-phenoxazine?
The IUPAC name of N,N-diphenylaniline;10H-phenoxazine (CID 174810342) is N,N-diphenylaniline;10H-phenoxazine.
What is the SMILES notation for N,N-diphenylaniline;10H-phenoxazine?
The canonical SMILES for N,N-diphenylaniline;10H-phenoxazine is c1ccc(N(c2ccccc2)c2ccccc2)cc1.c1ccc2c(c1)Nc1ccccc1O2.
What is the InChIKey of N,N-diphenylaniline;10H-phenoxazine?
The InChIKey is SBQHZNZQRKHMAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15N.C12H9NO/c1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-3-7-11-9(5-1)13-10-6-2-4-8-12(10)14-11/h1-15H;1-8,13H.
What are the key properties of N,N-diphenylaniline;10H-phenoxazine?
N,N-diphenylaniline;10H-phenoxazine has a molecular weight of 428.54 g/mol, XLogP of 8.69, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diphenylaniline;10H-phenoxazine is sourced from PubChem (CID 174810342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).