3-(2-phenylphenyl)perylene

C32H20 — CID 174610298

IUPAC3-(2-phenylphenyl)perylene
SMILESc1ccc(-c2ccccc2-c2ccc3c4cccc5cccc(c6cccc2c63)c54)cc1
InChIInChI=1S/C32H20/c1-2-9-21(10-3-1)23-13-4-5-14-24(23)25-19-20-30-28-16-7-12-22-11-6-15-27(31(22)28)29-18-8-17-26(25)32(29)30/h1-20H
InChIKeyHGSKJXCHRSPOHN-UHFFFAOYSA-N
MW404.51 g/mol
LogP9.07
Rot. Bonds2

About 3-(2-phenylphenyl)perylene

3-(2-phenylphenyl)perylene (PubChem CID 174610298) has the molecular formula C32H20 and a molecular weight of 404.51 g/mol. Its IUPAC name is 3-(2-phenylphenyl)perylene.

Molecular Properties

Compound Name3-(2-phenylphenyl)perylene
PubChem CID174610298
Molecular FormulaC32H20
Molecular Weight404.51 g/mol
Exact Mass404.16
IUPAC Name3-(2-phenylphenyl)perylene
SMILESc1ccc(-c2ccccc2-c2ccc3c4cccc5cccc(c6cccc2c63)c54)cc1
InChIInChI=1S/C32H20/c1-2-9-21(10-3-1)23-13-4-5-14-24(23)25-19-20-30-28-16-7-12-22-11-6-15-27(31(22)28)29-18-8-17-26(25)32(29)30/h1-20H
InChIKeyHGSKJXCHRSPOHN-UHFFFAOYSA-N
XLogP9.07
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500404.51
LogP ≤ 59.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze 3-(2-phenylphenyl)perylene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-naphthalen-1-yl-6-[6-[6-(2-phenylphenyl)pyren-1-yl]pyren-1-yl]pyrene
CID 58908206
9-phenyl-14-(2-phenylphenyl)undecacyclo[18.16.1.12,15.14,8.122,26.03,13.021,31.033,37.012,40.019,39.030,38]tetraconta-1(36),2,4,6,8,10,12(40),13,15,17,19(39),20(37),21(31),22,24,26(38),27,29,32,34-icosaene
CID 59642416
1-[2-(4-phenyl-3-pyren-1-ylphenyl)phenyl]pyrene
CID 169303152
3,19-bis(2-phenylphenyl)tridecacyclo[22.17.2.225,28.17,11.02,20.04,18.06,16.021,42.026,38.027,35.029,34.039,43.015,46]hexatetraconta-1(42),2,4(18),5,7,9,11(46),12,14,16,19,21,23,25(45),26(38),27(35),28(44),29,31,33,36,39(43),40-tricosaene
CID 140785297
25-(2-phenylphenyl)nonacyclo[20.10.1.18,12.02,20.05,19.07,17.023,28.029,33.016,34]tetratriaconta-1,3,5,7(17),8,10,12(34),13,15,18,20,22(33),23(28),24,26,29,31-heptadecaene
CID 123683020
4-[2-[10-[2-(4-aminophenyl)phenyl]perylen-3-yl]phenyl]aniline
CID 171053057
1-[4-(4-phenylphenyl)naphthalen-1-yl]pyrene
CID 156656874
2-(4-phenylnaphthalen-1-yl)-4-(2-phenylphenyl)-6-(4-pyren-1-ylnaphthalen-1-yl)-1,3,5-triazine
CID 176632742
1,6-bis(4-phenylnaphthalen-1-yl)-3,8-bis(2-phenylphenyl)pyrene
CID 59391228
1-[3-[8-(2-phenylphenyl)-4-pyren-1-ylnaphthalen-2-yl]naphthalen-1-yl]pyrene
CID 169303179
1-[4-naphthalen-1-yl-3-(3-phenyl-4-pyren-1-ylphenyl)phenyl]pyrene
CID 169303234
9,32-diphenyl-14-(2-phenylphenyl)undecacyclo[18.16.1.12,15.14,8.122,26.03,13.021,31.033,37.012,40.019,39.030,38]tetraconta-1(37),2,4,6,8,10,12(40),13,15,17,19(39),20,22,24,26(38),27,29,31,33,35-icosaene;7,9,14,16,32-pentakis-phenylundecacyclo[18.16.1.12,15.14,8.122,26.03,13.021,31.033,37.012,40.019,39.030,38]tetraconta-1(37),2,4(40),5,7,9,11,13,15,17,19(39),20,22,24,26(38),27,29,31,33,35-icosaene;14-phenyl-32-(2-phenylphenyl)undecacyclo[18.16.1.12,15.14,8.122,26.03,13.021,31.033,37.012,40.019,39.030,38]tetraconta-1(37),2,4,6,8(40),9,11,13,15,17,19(39),20,22,24,26(38),27,29,31,33,35-icosaene;14-(2-phenylphenyl)undecacyclo[18.16.1.12,15.14,8.122,26.03,13.021,31.033,37.012,40.019,39.030,38]tetraconta-1(36),2,4,6,8(40),9,11,13,15,17,19(39),20(37),21(31),22,24,26(38),27,29,32,34-icosaene;9,14,16,32-tetraphenylundecacyclo[18.16.1.12,15.14,8.122,26.03,13.021,31.033,37.012,40.019,39.030,38]tetraconta-1(37),2,4,6,8,10,12(40),13,15,17,19(39),20,22,24,26(38),27,29,31,33,35-icosaene;7,9,32-triphenyl-14-(2-phenylphenyl)undecacyclo[18.16.1.12,15.14,8.122,26.03,13.021,31.033,37.012,40.019,39.030,38]tetraconta-1(37),2,4(40),5,7,9,11,13,15,17,19(39),20,22,24,26(38),27,29,31,33,35-icosaene
CID 158568579

Frequently Asked Questions

What is the IUPAC name of 3-(2-phenylphenyl)perylene?
The IUPAC name of 3-(2-phenylphenyl)perylene (CID 174610298) is 3-(2-phenylphenyl)perylene.
What is the SMILES notation for 3-(2-phenylphenyl)perylene?
The canonical SMILES for 3-(2-phenylphenyl)perylene is c1ccc(-c2ccccc2-c2ccc3c4cccc5cccc(c6cccc2c63)c54)cc1.
What is the InChIKey of 3-(2-phenylphenyl)perylene?
The InChIKey is HGSKJXCHRSPOHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H20/c1-2-9-21(10-3-1)23-13-4-5-14-24(23)25-19-20-30-28-16-7-12-22-11-6-15-27(31(22)28)29-18-8-17-26(25)32(29)30/h1-20H.
What are the key properties of 3-(2-phenylphenyl)perylene?
3-(2-phenylphenyl)perylene has a molecular weight of 404.51 g/mol, XLogP of 9.07, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-phenylphenyl)perylene is sourced from PubChem (CID 174610298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).