9-[9-(3-pyridin-2-yloxyphenyl)carbazol-2-yl]pyrido[2,3-b]indole

C34H22N4O — CID 140680930

IUPAC9-[9-(3-pyridin-2-yloxyphenyl)carbazol-2-yl]pyrido[2,3-b]indole
SMILESc1ccc(Oc2cccc(-n3c4ccccc4c4ccc(-n5c6ccccc6c6cccnc65)cc43)c2)nc1
InChIInChI=1S/C34H22N4O/c1-3-14-30-26(11-1)28-18-17-24(38-31-15-4-2-12-27(31)29-13-8-20-36-34(29)38)22-32(28)37(30)23-9-7-10-25(21-23)39-33-16-5-6-19-35-33/h1-22H
InChIKeyGTILGMWMZUILMF-UHFFFAOYSA-N
MW502.58 g/mol
LogP8.46
Rot. Bonds4

About 9-[9-(3-pyridin-2-yloxyphenyl)carbazol-2-yl]pyrido[2,3-b]indole

9-[9-(3-pyridin-2-yloxyphenyl)carbazol-2-yl]pyrido[2,3-b]indole (PubChem CID 140680930) has the molecular formula C34H22N4O and a molecular weight of 502.58 g/mol. Its IUPAC name is 9-[9-(3-pyridin-2-yloxyphenyl)carbazol-2-yl]pyrido[2,3-b]indole.

Molecular Properties

Compound Name9-[9-(3-pyridin-2-yloxyphenyl)carbazol-2-yl]pyrido[2,3-b]indole
PubChem CID140680930
Molecular FormulaC34H22N4O
Molecular Weight502.58 g/mol
Exact Mass502.18
IUPAC Name9-[9-(3-pyridin-2-yloxyphenyl)carbazol-2-yl]pyrido[2,3-b]indole
SMILESc1ccc(Oc2cccc(-n3c4ccccc4c4ccc(-n5c6ccccc6c6cccnc65)cc43)c2)nc1
InChIInChI=1S/C34H22N4O/c1-3-14-30-26(11-1)28-18-17-24(38-31-15-4-2-12-27(31)29-13-8-20-36-34(29)38)22-32(28)37(30)23-9-7-10-25(21-23)39-33-16-5-6-19-35-33/h1-22H
InChIKeyGTILGMWMZUILMF-UHFFFAOYSA-N
XLogP8.46
TPSA44.87 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms39
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500502.58
LogP ≤ 58.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 9-[9-(3-pyridin-2-yloxyphenyl)carbazol-2-yl]pyrido[2,3-b]indole?
The IUPAC name of 9-[9-(3-pyridin-2-yloxyphenyl)carbazol-2-yl]pyrido[2,3-b]indole (CID 140680930) is 9-[9-(3-pyridin-2-yloxyphenyl)carbazol-2-yl]pyrido[2,3-b]indole.
What is the SMILES notation for 9-[9-(3-pyridin-2-yloxyphenyl)carbazol-2-yl]pyrido[2,3-b]indole?
The canonical SMILES for 9-[9-(3-pyridin-2-yloxyphenyl)carbazol-2-yl]pyrido[2,3-b]indole is c1ccc(Oc2cccc(-n3c4ccccc4c4ccc(-n5c6ccccc6c6cccnc65)cc43)c2)nc1.
What is the InChIKey of 9-[9-(3-pyridin-2-yloxyphenyl)carbazol-2-yl]pyrido[2,3-b]indole?
The InChIKey is GTILGMWMZUILMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H22N4O/c1-3-14-30-26(11-1)28-18-17-24(38-31-15-4-2-12-27(31)29-13-8-20-36-34(29)38)22-32(28)37(30)23-9-7-10-25(21-23)39-33-16-5-6-19-35-33/h1-22H.
What are the key properties of 9-[9-(3-pyridin-2-yloxyphenyl)carbazol-2-yl]pyrido[2,3-b]indole?
9-[9-(3-pyridin-2-yloxyphenyl)carbazol-2-yl]pyrido[2,3-b]indole has a molecular weight of 502.58 g/mol, XLogP of 8.46, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[9-(3-pyridin-2-yloxyphenyl)carbazol-2-yl]pyrido[2,3-b]indole is sourced from PubChem (CID 140680930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).