5-(4-methylphenyl)-10-phenyl-15,20-dipyridin-3-yl-21,22,23,24-tetrahydroporphyrin

C43H32N6 — CID 90850065

IUPAC5-(4-methylphenyl)-10-phenyl-15,20-dipyridin-3-yl-21,22,23,24-tetrahydroporphyrin
SMILESCc1ccc(C2=c3ccc([nH]3)=C(c3cccnc3)c3ccc([nH]3)C(c3cccnc3)=c3ccc([nH]3)=C(c3ccccc3)c3ccc2[nH]3)cc1
InChIInChI=1S/C43H32N6/c1-27-11-13-29(14-12-27)41-34-16-15-32(46-34)40(28-7-3-2-4-8-28)33-17-19-36(47-33)42(30-9-5-23-44-25-30)38-21-22-39(49-38)43(31-10-6-24-45-26-31)37-20-18-35(41)48-37/h2-26,46-49H,1H3
InChIKeyRGOWSSNLGPTZQX-UHFFFAOYSA-N
MW632.77 g/mol
LogP5.40
Rot. Bonds4

About 5-(4-methylphenyl)-10-phenyl-15,20-dipyridin-3-yl-21,22,23,24-tetrahydroporphyrin

5-(4-methylphenyl)-10-phenyl-15,20-dipyridin-3-yl-21,22,23,24-tetrahydroporphyrin (PubChem CID 90850065) has the molecular formula C43H32N6 and a molecular weight of 632.77 g/mol. Its IUPAC name is 5-(4-methylphenyl)-10-phenyl-15,20-dipyridin-3-yl-21,22,23,24-tetrahydroporphyrin.

Molecular Properties

Compound Name5-(4-methylphenyl)-10-phenyl-15,20-dipyridin-3-yl-21,22,23,24-tetrahydroporphyrin
PubChem CID90850065
Molecular FormulaC43H32N6
Molecular Weight632.77 g/mol
Exact Mass632.27
IUPAC Name5-(4-methylphenyl)-10-phenyl-15,20-dipyridin-3-yl-21,22,23,24-tetrahydroporphyrin
SMILESCc1ccc(C2=c3ccc([nH]3)=C(c3cccnc3)c3ccc([nH]3)C(c3cccnc3)=c3ccc([nH]3)=C(c3ccccc3)c3ccc2[nH]3)cc1
InChIInChI=1S/C43H32N6/c1-27-11-13-29(14-12-27)41-34-16-15-32(46-34)40(28-7-3-2-4-8-28)33-17-19-36(47-33)42(30-9-5-23-44-25-30)38-21-22-39(49-38)43(31-10-6-24-45-26-31)37-20-18-35(41)48-37/h2-26,46-49H,1H3
InChIKeyRGOWSSNLGPTZQX-UHFFFAOYSA-N
XLogP5.40
TPSA88.94 Ų
H-Bond Donors4
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms49
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500632.77
LogP ≤ 55.40
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 102

Analyze 5-(4-methylphenyl)-10-phenyl-15,20-dipyridin-3-yl-21,22,23,24-tetrahydroporphyrin 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

N-[4-(10,15,20-tripyridin-3-yl-21,22,23,24-tetrahydroporphyrin-5-yl)phenyl]acetamide
CID 91485582
5-(4-methylphenyl)-10,15,20-tripyridin-4-yl-21,22,23,24-tetrahydroporphyrin
CID 91460206
iron(3+);5,10,15,20-tetraphenyl-21,22,23,24-tetrahydroporphyrin;trichloride
CID 159454747
3-[3-methyl-5-(4-methylphenyl)phenyl]pyridine
CID 130388822
3-(3,5-diphenylphenyl)pyridine
CID 141411458
2,7,12,17-tetraphenyl-4,21,22,23-tetrazapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1,3(24),5,7,9,11,13,15,17,19-decaene
CID 91265450
3-[3-[3-phenyl-5-[3-[3-[3-(4-phenylphenyl)phenyl]phenyl]phenyl]phenyl]-5-pyridin-3-ylphenyl]pyridine
CID 126704951
ethane;methane;3-methylpyridine;toluene;1,4-xylene
CID 159514301
3-(2,5-dimethyl-4-pyridin-3-ylphenyl)pyridine
CID 155748097
benzene;3-[3-[3-(3,5-dipyridin-3-ylphenyl)phenyl]-5-pyridin-3-ylphenyl]pyridine
CID 158338475
3-[4-[2,4-bis(4-phenylphenyl)-5-(4-pyridin-3-ylphenyl)phenyl]phenyl]pyridine
CID 67990643
3-(2-methylphenyl)pyridine
CID 4133191

Frequently Asked Questions

What is the IUPAC name of 5-(4-methylphenyl)-10-phenyl-15,20-dipyridin-3-yl-21,22,23,24-tetrahydroporphyrin?
The IUPAC name of 5-(4-methylphenyl)-10-phenyl-15,20-dipyridin-3-yl-21,22,23,24-tetrahydroporphyrin (CID 90850065) is 5-(4-methylphenyl)-10-phenyl-15,20-dipyridin-3-yl-21,22,23,24-tetrahydroporphyrin.
What is the SMILES notation for 5-(4-methylphenyl)-10-phenyl-15,20-dipyridin-3-yl-21,22,23,24-tetrahydroporphyrin?
The canonical SMILES for 5-(4-methylphenyl)-10-phenyl-15,20-dipyridin-3-yl-21,22,23,24-tetrahydroporphyrin is Cc1ccc(C2=c3ccc([nH]3)=C(c3cccnc3)c3ccc([nH]3)C(c3cccnc3)=c3ccc([nH]3)=C(c3ccccc3)c3ccc2[nH]3)cc1.
What is the InChIKey of 5-(4-methylphenyl)-10-phenyl-15,20-dipyridin-3-yl-21,22,23,24-tetrahydroporphyrin?
The InChIKey is RGOWSSNLGPTZQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C43H32N6/c1-27-11-13-29(14-12-27)41-34-16-15-32(46-34)40(28-7-3-2-4-8-28)33-17-19-36(47-33)42(30-9-5-23-44-25-30)38-21-22-39(49-38)43(31-10-6-24-45-26-31)37-20-18-35(41)48-37/h2-26,46-49H,1H3.
What are the key properties of 5-(4-methylphenyl)-10-phenyl-15,20-dipyridin-3-yl-21,22,23,24-tetrahydroporphyrin?
5-(4-methylphenyl)-10-phenyl-15,20-dipyridin-3-yl-21,22,23,24-tetrahydroporphyrin has a molecular weight of 632.77 g/mol, XLogP of 5.40, 4 rotatable bonds, 4 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-methylphenyl)-10-phenyl-15,20-dipyridin-3-yl-21,22,23,24-tetrahydroporphyrin is sourced from PubChem (CID 90850065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).