2-(5-methyl-10-pyridin-2-ylphenazin-2-yl)-7-(N-phenylanilino)-5-propan-2-ylquinolin-8-ol

C42H35N5O — CID 171580256

IUPAC2-(5-methyl-10-pyridin-2-ylphenazin-2-yl)-7-(N-phenylanilino)-5-propan-2-ylquinolin-8-ol
SMILESCC(C)c1cc(N(c2ccccc2)c2ccccc2)c(O)c2nc(-c3ccc4c(c3)N(c3ccccn3)c3ccccc3N4C)ccc12
InChIInChI=1S/C42H35N5O/c1-28(2)33-27-39(46(30-14-6-4-7-15-30)31-16-8-5-9-17-31)42(48)41-32(33)22-23-34(44-41)29-21-24-36-38(26-29)47(40-20-12-13-25-43-40)37-19-11-10-18-35(37)45(36)3/h4-28,48H,1-3H3
InChIKeyOYRCMMPTNOETGX-UHFFFAOYSA-N
MW625.78 g/mol
LogP11.15
Rot. Bonds6

About 2-(5-methyl-10-pyridin-2-ylphenazin-2-yl)-7-(N-phenylanilino)-5-propan-2-ylquinolin-8-ol

2-(5-methyl-10-pyridin-2-ylphenazin-2-yl)-7-(N-phenylanilino)-5-propan-2-ylquinolin-8-ol (PubChem CID 171580256) has the molecular formula C42H35N5O and a molecular weight of 625.78 g/mol. Its IUPAC name is 2-(5-methyl-10-pyridin-2-ylphenazin-2-yl)-7-(N-phenylanilino)-5-propan-2-ylquinolin-8-ol.

Molecular Properties

Compound Name2-(5-methyl-10-pyridin-2-ylphenazin-2-yl)-7-(N-phenylanilino)-5-propan-2-ylquinolin-8-ol
PubChem CID171580256
Molecular FormulaC42H35N5O
Molecular Weight625.78 g/mol
Exact Mass625.28
IUPAC Name2-(5-methyl-10-pyridin-2-ylphenazin-2-yl)-7-(N-phenylanilino)-5-propan-2-ylquinolin-8-ol
SMILESCC(C)c1cc(N(c2ccccc2)c2ccccc2)c(O)c2nc(-c3ccc4c(c3)N(c3ccccn3)c3ccccc3N4C)ccc12
InChIInChI=1S/C42H35N5O/c1-28(2)33-27-39(46(30-14-6-4-7-15-30)31-16-8-5-9-17-31)42(48)41-32(33)22-23-34(44-41)29-21-24-36-38(26-29)47(40-20-12-13-25-43-40)37-19-11-10-18-35(37)45(36)3/h4-28,48H,1-3H3
InChIKeyOYRCMMPTNOETGX-UHFFFAOYSA-N
XLogP11.15
TPSA55.73 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms48
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500625.78
LogP ≤ 511.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 2-(5-methyl-10-pyridin-2-ylphenazin-2-yl)-7-(N-phenylanilino)-5-propan-2-ylquinolin-8-ol with MolForge

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Launch Full Analysis

Related Compounds

7-methoxy-2-(5-methyl-10-pyridin-2-ylphenazin-2-yl)-5-propan-2-ylquinolin-8-ol
CID 171580419
2-(4-methoxy-5-methyl-10-pyridin-2-ylphenazin-2-yl)-5-propan-2-ylquinolin-8-ol
CID 171579824
7-ethyl-2-(5-methyl-10-pyridin-2-yl-1H-phenazin-1-id-2-yl)-5-propan-2-ylquinolin-8-ol;platinum
CID 171580161
2-(9,9-dimethyl-10-pyridin-2-ylacridin-3-yl)-5-phenylquinolin-8-ol
CID 171580342
3-(9,9-dimethyl-10-pyridin-2-ylacridin-3-yl)benzo[f]quinolin-5-ol
CID 171580330
5-(dimethylamino)-2-[9,9-dimethyl-10-(4-propan-2-yl-2-pyridinyl)acridin-3-yl]quinolin-8-ol
CID 171579788
7-(dimethylamino)-2-[9,9-dimethyl-10-(4-phenyl-2-pyridinyl)acridin-3-yl]quinolin-8-ol
CID 171580134
2-[10-(4-propan-2-yl-2-pyridinyl)-5-(2,4,6-trimethylphenyl)phenazin-2-yl]quinolin-8-ol
CID 171580286
9,9-dimethyl-2-N,2-N,7-N,7-N-tetraphenyl-10-(10-phenylpyrazino[2,3-f][1,10]phenanthrolin-7-yl)acridine-2,7-diamine
CID 129089141
2,4-di(propan-2-yl)-6-[2-[3-(N-pyridin-2-ylanilino)phenyl]pyrido[2,3-b]indol-9-yl]phenol
CID 154590089
7-(4-tert-butylphenyl)-2-(9,9-dimethyl-10-pyridin-2-yl-4H-acridin-4-id-3-yl)-5-propan-2-ylquinolin-8-ol;platinum
CID 171579713
2-(8-isocyano-5-methyl-10-pyridin-2-yl-1H-phenazin-1-id-2-yl)-5-propan-2-ylquinolin-8-ol;platinum
CID 171580358

Frequently Asked Questions

What is the IUPAC name of 2-(5-methyl-10-pyridin-2-ylphenazin-2-yl)-7-(N-phenylanilino)-5-propan-2-ylquinolin-8-ol?
The IUPAC name of 2-(5-methyl-10-pyridin-2-ylphenazin-2-yl)-7-(N-phenylanilino)-5-propan-2-ylquinolin-8-ol (CID 171580256) is 2-(5-methyl-10-pyridin-2-ylphenazin-2-yl)-7-(N-phenylanilino)-5-propan-2-ylquinolin-8-ol.
What is the SMILES notation for 2-(5-methyl-10-pyridin-2-ylphenazin-2-yl)-7-(N-phenylanilino)-5-propan-2-ylquinolin-8-ol?
The canonical SMILES for 2-(5-methyl-10-pyridin-2-ylphenazin-2-yl)-7-(N-phenylanilino)-5-propan-2-ylquinolin-8-ol is CC(C)c1cc(N(c2ccccc2)c2ccccc2)c(O)c2nc(-c3ccc4c(c3)N(c3ccccn3)c3ccccc3N4C)ccc12.
What is the InChIKey of 2-(5-methyl-10-pyridin-2-ylphenazin-2-yl)-7-(N-phenylanilino)-5-propan-2-ylquinolin-8-ol?
The InChIKey is OYRCMMPTNOETGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C42H35N5O/c1-28(2)33-27-39(46(30-14-6-4-7-15-30)31-16-8-5-9-17-31)42(48)41-32(33)22-23-34(44-41)29-21-24-36-38(26-29)47(40-20-12-13-25-43-40)37-19-11-10-18-35(37)45(36)3/h4-28,48H,1-3H3.
What are the key properties of 2-(5-methyl-10-pyridin-2-ylphenazin-2-yl)-7-(N-phenylanilino)-5-propan-2-ylquinolin-8-ol?
2-(5-methyl-10-pyridin-2-ylphenazin-2-yl)-7-(N-phenylanilino)-5-propan-2-ylquinolin-8-ol has a molecular weight of 625.78 g/mol, XLogP of 11.15, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-methyl-10-pyridin-2-ylphenazin-2-yl)-7-(N-phenylanilino)-5-propan-2-ylquinolin-8-ol is sourced from PubChem (CID 171580256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).