2-[9-[4-(dimethylamino)-2-pyridinyl]carbazol-2-yl]oxy-5-methylquinolin-8-ol

C29H24N4O2 — CID 176606434

IUPAC2-[9-[4-(dimethylamino)-2-pyridinyl]carbazol-2-yl]oxy-5-methylquinolin-8-ol
SMILESCc1ccc(O)c2nc(Oc3ccc4c5ccccc5n(-c5cc(N(C)C)ccn5)c4c3)ccc12
InChIInChI=1S/C29H24N4O2/c1-18-8-12-26(34)29-21(18)11-13-28(31-29)35-20-9-10-23-22-6-4-5-7-24(22)33(25(23)17-20)27-16-19(32(2)3)14-15-30-27/h4-17,34H,1-3H3
InChIKeyAJNSGIXBABCNTA-UHFFFAOYSA-N
MW460.54 g/mol
LogP6.60
Rot. Bonds4

About 2-[9-[4-(dimethylamino)-2-pyridinyl]carbazol-2-yl]oxy-5-methylquinolin-8-ol

2-[9-[4-(dimethylamino)-2-pyridinyl]carbazol-2-yl]oxy-5-methylquinolin-8-ol (PubChem CID 176606434) has the molecular formula C29H24N4O2 and a molecular weight of 460.54 g/mol. Its IUPAC name is 2-[9-[4-(dimethylamino)-2-pyridinyl]carbazol-2-yl]oxy-5-methylquinolin-8-ol.

Molecular Properties

Compound Name2-[9-[4-(dimethylamino)-2-pyridinyl]carbazol-2-yl]oxy-5-methylquinolin-8-ol
PubChem CID176606434
Molecular FormulaC29H24N4O2
Molecular Weight460.54 g/mol
Exact Mass460.19
IUPAC Name2-[9-[4-(dimethylamino)-2-pyridinyl]carbazol-2-yl]oxy-5-methylquinolin-8-ol
SMILESCc1ccc(O)c2nc(Oc3ccc4c5ccccc5n(-c5cc(N(C)C)ccn5)c4c3)ccc12
InChIInChI=1S/C29H24N4O2/c1-18-8-12-26(34)29-21(18)11-13-28(31-29)35-20-9-10-23-22-6-4-5-7-24(22)33(25(23)17-20)27-16-19(32(2)3)14-15-30-27/h4-17,34H,1-3H3
InChIKeyAJNSGIXBABCNTA-UHFFFAOYSA-N
XLogP6.60
TPSA63.41 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500460.54
LogP ≤ 56.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 2-[9-[4-(dimethylamino)-2-pyridinyl]carbazol-2-yl]oxy-5-methylquinolin-8-ol with MolForge

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Related Compounds

2-[[9-[4-(dimethylamino)-2-pyridinyl]-1H-carbazol-1-id-2-yl]oxy]-4-methylquinolin-8-ol;platinum
CID 176605947
5-carbazol-9-yl-2-(9-pyridin-2-ylcarbazol-2-yl)oxyquinolin-8-ol
CID 176606537
5-tert-butyl-2-(9-pyridin-2-ylcarbazol-2-yl)oxyquinolin-8-ol
CID 176606050
5-propan-2-yl-2-(9-pyrazin-2-ylcarbazol-2-yl)oxyquinolin-8-ol
CID 176606879
4,7-dimethyl-2-(9-pyrazin-2-ylcarbazol-2-yl)oxyquinolin-8-ol
CID 176606675
2-[9-[4-(aziridin-1-yl)-5-methyl-2-pyridinyl]carbazol-2-yl]oxyquinolin-8-ol
CID 176605735
N,N-dimethyl-2-[2-[3-[5-[3-[9-(4-methyl-2-pyridinyl)carbazol-2-yl]oxyphenyl]pyrazin-2-yl]phenoxy]carbazol-9-yl]pyridin-4-amine
CID 157068270
2-[2-[3-(3,5-dimethylpyrazol-1-yl)phenoxy]carbazol-9-yl]-N,N-dimethylpyridin-4-amine;platinum
CID 158641122
2-[9-(4-ethyl-2-pyridinyl)carbazol-2-yl]oxy-4-(trifluoromethyl)quinolin-8-ol
CID 176606652
2-[6-tert-butyl-9-(4-methyl-2-pyridinyl)carbazol-2-yl]oxy-8-hydroxyquinoline-5-carbonitrile
CID 176606752
6-[9-(4-methyl-2-pyridinyl)carbazol-2-yl]oxy-1H-1,5-naphthyridin-4-one
CID 176606687
2-[9-(4-propan-2-yl-2-pyridinyl)carbazol-2-yl]oxyquinoline-8-thiol
CID 176606775

Frequently Asked Questions

What is the IUPAC name of 2-[9-[4-(dimethylamino)-2-pyridinyl]carbazol-2-yl]oxy-5-methylquinolin-8-ol?
The IUPAC name of 2-[9-[4-(dimethylamino)-2-pyridinyl]carbazol-2-yl]oxy-5-methylquinolin-8-ol (CID 176606434) is 2-[9-[4-(dimethylamino)-2-pyridinyl]carbazol-2-yl]oxy-5-methylquinolin-8-ol.
What is the SMILES notation for 2-[9-[4-(dimethylamino)-2-pyridinyl]carbazol-2-yl]oxy-5-methylquinolin-8-ol?
The canonical SMILES for 2-[9-[4-(dimethylamino)-2-pyridinyl]carbazol-2-yl]oxy-5-methylquinolin-8-ol is Cc1ccc(O)c2nc(Oc3ccc4c5ccccc5n(-c5cc(N(C)C)ccn5)c4c3)ccc12.
What is the InChIKey of 2-[9-[4-(dimethylamino)-2-pyridinyl]carbazol-2-yl]oxy-5-methylquinolin-8-ol?
The InChIKey is AJNSGIXBABCNTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H24N4O2/c1-18-8-12-26(34)29-21(18)11-13-28(31-29)35-20-9-10-23-22-6-4-5-7-24(22)33(25(23)17-20)27-16-19(32(2)3)14-15-30-27/h4-17,34H,1-3H3.
What are the key properties of 2-[9-[4-(dimethylamino)-2-pyridinyl]carbazol-2-yl]oxy-5-methylquinolin-8-ol?
2-[9-[4-(dimethylamino)-2-pyridinyl]carbazol-2-yl]oxy-5-methylquinolin-8-ol has a molecular weight of 460.54 g/mol, XLogP of 6.60, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[9-[4-(dimethylamino)-2-pyridinyl]carbazol-2-yl]oxy-5-methylquinolin-8-ol is sourced from PubChem (CID 176606434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).