ethane;10-phenylphenoxazine

C24H31NO — CID 123756019

IUPACethane;10-phenylphenoxazine
SMILESCC.CC.CC.c1ccc(N2c3ccccc3Oc3ccccc32)cc1
InChIInChI=1S/C18H13NO.3C2H6/c1-2-8-14(9-3-1)19-15-10-4-6-12-17(15)20-18-13-7-5-11-16(18)19;3*1-2/h1-13H;3*1-2H3
InChIKeyLSGQCPGIGBYWNL-UHFFFAOYSA-N
MW349.52 g/mol
LogP8.34
Rot. Bonds1

About ethane;10-phenylphenoxazine

ethane;10-phenylphenoxazine (PubChem CID 123756019) has the molecular formula C24H31NO and a molecular weight of 349.52 g/mol. Its IUPAC name is ethane;10-phenylphenoxazine.

Molecular Properties

Compound Nameethane;10-phenylphenoxazine
PubChem CID123756019
Molecular FormulaC24H31NO
Molecular Weight349.52 g/mol
Exact Mass349.24
IUPAC Nameethane;10-phenylphenoxazine
SMILESCC.CC.CC.c1ccc(N2c3ccccc3Oc3ccccc32)cc1
InChIInChI=1S/C18H13NO.3C2H6/c1-2-8-14(9-3-1)19-15-10-4-6-12-17(15)20-18-13-7-5-11-16(18)19;3*1-2/h1-13H;3*1-2H3
InChIKeyLSGQCPGIGBYWNL-UHFFFAOYSA-N
XLogP8.34
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500349.52
LogP ≤ 58.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1,1-dimethyl-22-phenyl-8,14-dioxa-22-aza-1λ5-stibahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9(21),10,12,15,17,19-nonaene
CID 140848985
10-(4-fluorophenyl)phenoxazine
CID 141389969
10-(3-methyl-5-phenoxazin-10-ylphenyl)phenoxazine
CID 145413452
10-phenyl-3-[4-(3-phenylphenyl)phenyl]phenoxazine
CID 155186108
22-phenyl-8,14-dioxa-22-aza-1-phosphahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9(21),10,12,15,17,19-nonaene
CID 134317568
N,10-diphenylphenoxazin-2-amine
CID 155429744
2,3-bis(ethenyl)-4-phenyl-1,4-benzoxazine;ethane
CID 145383928
1,1-dimethyl-14,22-diphenyl-8-oxa-14,22-diaza-1λ5-bismahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaene
CID 140848716
10-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenoxazine
CID 118528356
22-phenyl-8,14-dioxa-22-azahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9(21),10,12,15,17,19-nonaene
CID 118049683
14,22-diphenyl-8-oxa-14,22-diaza-1-bismahexacyclo[11.7.1.13,19.02,7.09,21.015,20]docosa-2,4,6,9,11,13(21),15,17,19-nonaene
CID 140849245
2-(9,9-dimethyl-10-phenylacridin-3-yl)-10-phenylphenoxazine
CID 146652293

Frequently Asked Questions

What is the IUPAC name of ethane;10-phenylphenoxazine?
The IUPAC name of ethane;10-phenylphenoxazine (CID 123756019) is ethane;10-phenylphenoxazine.
What is the SMILES notation for ethane;10-phenylphenoxazine?
The canonical SMILES for ethane;10-phenylphenoxazine is CC.CC.CC.c1ccc(N2c3ccccc3Oc3ccccc32)cc1.
What is the InChIKey of ethane;10-phenylphenoxazine?
The InChIKey is LSGQCPGIGBYWNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13NO.3C2H6/c1-2-8-14(9-3-1)19-15-10-4-6-12-17(15)20-18-13-7-5-11-16(18)19;3*1-2/h1-13H;3*1-2H3.
What are the key properties of ethane;10-phenylphenoxazine?
ethane;10-phenylphenoxazine has a molecular weight of 349.52 g/mol, XLogP of 8.34, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;10-phenylphenoxazine is sourced from PubChem (CID 123756019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).