9-(4-propan-2-yl-2-pyridinyl)-2-(3-pyridin-2-yloxyphenyl)carbazole

C31H25N3O — CID 153421041

IUPAC9-(4-propan-2-yl-2-pyridinyl)-2-(3-pyridin-2-yloxyphenyl)carbazole
SMILESCC(C)c1ccnc(-n2c3ccccc3c3ccc(-c4cccc(Oc5ccccn5)c4)cc32)c1
InChIInChI=1S/C31H25N3O/c1-21(2)22-15-17-32-30(20-22)34-28-11-4-3-10-26(28)27-14-13-24(19-29(27)34)23-8-7-9-25(18-23)35-31-12-5-6-16-33-31/h3-21H,1-2H3
InChIKeyUOOSJKYAXWBUIV-UHFFFAOYSA-N
MW455.56 g/mol
LogP8.16
Rot. Bonds5

About 9-(4-propan-2-yl-2-pyridinyl)-2-(3-pyridin-2-yloxyphenyl)carbazole

9-(4-propan-2-yl-2-pyridinyl)-2-(3-pyridin-2-yloxyphenyl)carbazole (PubChem CID 153421041) has the molecular formula C31H25N3O and a molecular weight of 455.56 g/mol. Its IUPAC name is 9-(4-propan-2-yl-2-pyridinyl)-2-(3-pyridin-2-yloxyphenyl)carbazole.

Molecular Properties

Compound Name9-(4-propan-2-yl-2-pyridinyl)-2-(3-pyridin-2-yloxyphenyl)carbazole
PubChem CID153421041
Molecular FormulaC31H25N3O
Molecular Weight455.56 g/mol
Exact Mass455.20
IUPAC Name9-(4-propan-2-yl-2-pyridinyl)-2-(3-pyridin-2-yloxyphenyl)carbazole
SMILESCC(C)c1ccnc(-n2c3ccccc3c3ccc(-c4cccc(Oc5ccccn5)c4)cc32)c1
InChIInChI=1S/C31H25N3O/c1-21(2)22-15-17-32-30(20-22)34-28-11-4-3-10-26(28)27-14-13-24(19-29(27)34)23-8-7-9-25(18-23)35-31-12-5-6-16-33-31/h3-21H,1-2H3
InChIKeyUOOSJKYAXWBUIV-UHFFFAOYSA-N
XLogP8.16
TPSA39.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500455.56
LogP ≤ 58.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

9-(3,4-dideuterio-2-pyridinyl)-2-(3-pyridin-2-yloxyphenyl)carbazole
CID 153421326
2-[3-[(4-methoxy-2-pyridinyl)oxy]phenyl]-9-pyridin-2-ylcarbazole
CID 153421155
9-(3,5-dideuterio-2-pyridinyl)-2-(3-pyridin-2-yloxyphenyl)carbazole
CID 153421777
9-(4-piperidin-1-yl-2-pyridinyl)-2-(3-pyridin-2-yloxyphenyl)carbazole
CID 153421765
2-[3-[(5-tert-butyl-2-pyridinyl)oxy]phenyl]-9-pyridin-2-ylcarbazole
CID 153421793
2-(3-pyridin-2-yloxyphenyl)-9-(1,2,4-triazin-3-yl)carbazole
CID 153421215
9-(5-deuterio-2-pyridinyl)-2-[3-[(4-deuterio-2-pyridinyl)oxy]phenyl]carbazole
CID 153421368
9-(3-tert-butyl-2-pyridinyl)-2-(3-pyridin-2-yloxyphenyl)carbazole
CID 153421221
9-(4-tert-butyl-2-pyridinyl)-2-(5-pyridin-2-yloxy-3-pyridinyl)carbazole
CID 153421354
9-(4-ethyl-2-pyridinyl)-2-[3-[(6-ethyl-2-pyridinyl)oxy]phenyl]carbazole
CID 153421163
2-[9-(4-propan-2-yl-2-pyridinyl)carbazol-2-yl]oxyquinoline-8-thiol
CID 176606775
6-tert-butyl-9-(5-tert-butyl-2-pyridinyl)-2-(3-pyridin-2-yloxyphenyl)carbazole
CID 153421247

Frequently Asked Questions

What is the IUPAC name of 9-(4-propan-2-yl-2-pyridinyl)-2-(3-pyridin-2-yloxyphenyl)carbazole?
The IUPAC name of 9-(4-propan-2-yl-2-pyridinyl)-2-(3-pyridin-2-yloxyphenyl)carbazole (CID 153421041) is 9-(4-propan-2-yl-2-pyridinyl)-2-(3-pyridin-2-yloxyphenyl)carbazole.
What is the SMILES notation for 9-(4-propan-2-yl-2-pyridinyl)-2-(3-pyridin-2-yloxyphenyl)carbazole?
The canonical SMILES for 9-(4-propan-2-yl-2-pyridinyl)-2-(3-pyridin-2-yloxyphenyl)carbazole is CC(C)c1ccnc(-n2c3ccccc3c3ccc(-c4cccc(Oc5ccccn5)c4)cc32)c1.
What is the InChIKey of 9-(4-propan-2-yl-2-pyridinyl)-2-(3-pyridin-2-yloxyphenyl)carbazole?
The InChIKey is UOOSJKYAXWBUIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H25N3O/c1-21(2)22-15-17-32-30(20-22)34-28-11-4-3-10-26(28)27-14-13-24(19-29(27)34)23-8-7-9-25(18-23)35-31-12-5-6-16-33-31/h3-21H,1-2H3.
What are the key properties of 9-(4-propan-2-yl-2-pyridinyl)-2-(3-pyridin-2-yloxyphenyl)carbazole?
9-(4-propan-2-yl-2-pyridinyl)-2-(3-pyridin-2-yloxyphenyl)carbazole has a molecular weight of 455.56 g/mol, XLogP of 8.16, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(4-propan-2-yl-2-pyridinyl)-2-(3-pyridin-2-yloxyphenyl)carbazole is sourced from PubChem (CID 153421041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).