9-(4-piperidin-1-yl-2-pyridinyl)-2-(3-pyridin-2-yloxyphenyl)carbazole

C33H28N4O — CID 153421765

IUPAC9-(4-piperidin-1-yl-2-pyridinyl)-2-(3-pyridin-2-yloxyphenyl)carbazole
SMILESc1ccc(Oc2cccc(-c3ccc4c5ccccc5n(-c5cc(N6CCCCC6)ccn5)c4c3)c2)nc1
InChIInChI=1S/C33H28N4O/c1-6-19-36(20-7-1)26-16-18-34-32(23-26)37-30-12-3-2-11-28(30)29-15-14-25(22-31(29)37)24-9-8-10-27(21-24)38-33-13-4-5-17-35-33/h2-5,8-18,21-23H,1,6-7,19-20H2
InChIKeyGOQHDJFFRJJXDT-UHFFFAOYSA-N
MW496.61 g/mol
LogP8.02
Rot. Bonds5

About 9-(4-piperidin-1-yl-2-pyridinyl)-2-(3-pyridin-2-yloxyphenyl)carbazole

9-(4-piperidin-1-yl-2-pyridinyl)-2-(3-pyridin-2-yloxyphenyl)carbazole (PubChem CID 153421765) has the molecular formula C33H28N4O and a molecular weight of 496.61 g/mol. Its IUPAC name is 9-(4-piperidin-1-yl-2-pyridinyl)-2-(3-pyridin-2-yloxyphenyl)carbazole.

Molecular Properties

Compound Name9-(4-piperidin-1-yl-2-pyridinyl)-2-(3-pyridin-2-yloxyphenyl)carbazole
PubChem CID153421765
Molecular FormulaC33H28N4O
Molecular Weight496.61 g/mol
Exact Mass496.23
IUPAC Name9-(4-piperidin-1-yl-2-pyridinyl)-2-(3-pyridin-2-yloxyphenyl)carbazole
SMILESc1ccc(Oc2cccc(-c3ccc4c5ccccc5n(-c5cc(N6CCCCC6)ccn5)c4c3)c2)nc1
InChIInChI=1S/C33H28N4O/c1-6-19-36(20-7-1)26-16-18-34-32(23-26)37-30-12-3-2-11-28(30)29-15-14-25(22-31(29)37)24-9-8-10-27(21-24)38-33-13-4-5-17-35-33/h2-5,8-18,21-23H,1,6-7,19-20H2
InChIKeyGOQHDJFFRJJXDT-UHFFFAOYSA-N
XLogP8.02
TPSA43.18 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms38
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500496.61
LogP ≤ 58.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

9-(4-propan-2-yl-2-pyridinyl)-2-(3-pyridin-2-yloxyphenyl)carbazole
CID 153421041
9-(3,4-dideuterio-2-pyridinyl)-2-(3-pyridin-2-yloxyphenyl)carbazole
CID 153421326
9-(3,5-dideuterio-2-pyridinyl)-2-(3-pyridin-2-yloxyphenyl)carbazole
CID 153421777
2-[3-[(4-methoxy-2-pyridinyl)oxy]phenyl]-9-pyridin-2-ylcarbazole
CID 153421155
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
2-[3-[(5-tert-butyl-2-pyridinyl)oxy]phenyl]-9-pyridin-2-ylcarbazole
CID 153421793
9-(4-cyclopentyl-2-pyridinyl)-2-[3-[(4-methoxy-2-pyridinyl)oxy]phenyl]carbazole
CID 153421975
9-(6-methyl-2-pyridinyl)-2-[3-[(4-methyl-2-pyridinyl)oxy]phenyl]carbazole
CID 153421943
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

Frequently Asked Questions

What is the IUPAC name of 9-(4-piperidin-1-yl-2-pyridinyl)-2-(3-pyridin-2-yloxyphenyl)carbazole?
The IUPAC name of 9-(4-piperidin-1-yl-2-pyridinyl)-2-(3-pyridin-2-yloxyphenyl)carbazole (CID 153421765) is 9-(4-piperidin-1-yl-2-pyridinyl)-2-(3-pyridin-2-yloxyphenyl)carbazole.
What is the SMILES notation for 9-(4-piperidin-1-yl-2-pyridinyl)-2-(3-pyridin-2-yloxyphenyl)carbazole?
The canonical SMILES for 9-(4-piperidin-1-yl-2-pyridinyl)-2-(3-pyridin-2-yloxyphenyl)carbazole is c1ccc(Oc2cccc(-c3ccc4c5ccccc5n(-c5cc(N6CCCCC6)ccn5)c4c3)c2)nc1.
What is the InChIKey of 9-(4-piperidin-1-yl-2-pyridinyl)-2-(3-pyridin-2-yloxyphenyl)carbazole?
The InChIKey is GOQHDJFFRJJXDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H28N4O/c1-6-19-36(20-7-1)26-16-18-34-32(23-26)37-30-12-3-2-11-28(30)29-15-14-25(22-31(29)37)24-9-8-10-27(21-24)38-33-13-4-5-17-35-33/h2-5,8-18,21-23H,1,6-7,19-20H2.
What are the key properties of 9-(4-piperidin-1-yl-2-pyridinyl)-2-(3-pyridin-2-yloxyphenyl)carbazole?
9-(4-piperidin-1-yl-2-pyridinyl)-2-(3-pyridin-2-yloxyphenyl)carbazole has a molecular weight of 496.61 g/mol, XLogP of 8.02, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(4-piperidin-1-yl-2-pyridinyl)-2-(3-pyridin-2-yloxyphenyl)carbazole is sourced from PubChem (CID 153421765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).