9-(4-cyclopentyl-2-pyridinyl)-2-[3-[(4-methoxy-2-pyridinyl)oxy]phenyl]carbazole

C34H29N3O2 — CID 153421975

IUPAC9-(4-cyclopentyl-2-pyridinyl)-2-[3-[(4-methoxy-2-pyridinyl)oxy]phenyl]carbazole
SMILESCOc1ccnc(Oc2cccc(-c3ccc4c5ccccc5n(-c5cc(C6CCCC6)ccn5)c4c3)c2)c1
InChIInChI=1S/C34H29N3O2/c1-38-27-16-18-36-34(22-27)39-28-10-6-9-24(19-28)25-13-14-30-29-11-4-5-12-31(29)37(32(30)20-25)33-21-26(15-17-35-33)23-7-2-3-8-23/h4-6,9-23H,2-3,7-8H2,1H3
InChIKeyDBSPGZIZHZEKGS-UHFFFAOYSA-N
MW511.63 g/mol
LogP8.70
Rot. Bonds6

About 9-(4-cyclopentyl-2-pyridinyl)-2-[3-[(4-methoxy-2-pyridinyl)oxy]phenyl]carbazole

9-(4-cyclopentyl-2-pyridinyl)-2-[3-[(4-methoxy-2-pyridinyl)oxy]phenyl]carbazole (PubChem CID 153421975) has the molecular formula C34H29N3O2 and a molecular weight of 511.63 g/mol. Its IUPAC name is 9-(4-cyclopentyl-2-pyridinyl)-2-[3-[(4-methoxy-2-pyridinyl)oxy]phenyl]carbazole.

Molecular Properties

Compound Name9-(4-cyclopentyl-2-pyridinyl)-2-[3-[(4-methoxy-2-pyridinyl)oxy]phenyl]carbazole
PubChem CID153421975
Molecular FormulaC34H29N3O2
Molecular Weight511.63 g/mol
Exact Mass511.23
IUPAC Name9-(4-cyclopentyl-2-pyridinyl)-2-[3-[(4-methoxy-2-pyridinyl)oxy]phenyl]carbazole
SMILESCOc1ccnc(Oc2cccc(-c3ccc4c5ccccc5n(-c5cc(C6CCCC6)ccn5)c4c3)c2)c1
InChIInChI=1S/C34H29N3O2/c1-38-27-16-18-36-34(22-27)39-28-10-6-9-24(19-28)25-13-14-30-29-11-4-5-12-31(29)37(32(30)20-25)33-21-26(15-17-35-33)23-7-2-3-8-23/h4-6,9-23H,2-3,7-8H2,1H3
InChIKeyDBSPGZIZHZEKGS-UHFFFAOYSA-N
XLogP8.70
TPSA49.17 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms39
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500511.63
LogP ≤ 58.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-[3-[(4-methoxy-2-pyridinyl)oxy]phenyl]-9-pyridin-2-ylcarbazole
CID 153421155
9-(4-cyclobutyl-2-pyridinyl)-2-[3-[(4-methoxy-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;platinum(2+)
CID 153421470
9-(4-propan-2-yl-2-pyridinyl)-2-(3-pyridin-2-yloxyphenyl)carbazole
CID 153421041
9-(4-piperidin-1-yl-2-pyridinyl)-2-(3-pyridin-2-yloxyphenyl)carbazole
CID 153421765
9-(6-methyl-2-pyridinyl)-2-[3-[(4-methyl-2-pyridinyl)oxy]phenyl]carbazole
CID 153421943
2-[3-[5-[3-[9-(4-methoxy-2-pyridinyl)carbazol-2-yl]oxyphenyl]pyrazin-2-yl]phenoxy]-9-(4-methyl-2-pyridinyl)carbazole
CID 158912779
9-(3,4-dideuterio-2-pyridinyl)-2-(3-pyridin-2-yloxyphenyl)carbazole
CID 153421326
9-(5-deuterio-2-pyridinyl)-2-[3-[(4-deuterio-2-pyridinyl)oxy]phenyl]carbazole
CID 153421368
9-(3,5-dideuterio-2-pyridinyl)-2-(3-pyridin-2-yloxyphenyl)carbazole
CID 153421777
9-(4-ethyl-2-pyridinyl)-2-[3-[(6-ethyl-2-pyridinyl)oxy]phenyl]carbazole
CID 153421163
2-[3-[3,5-dicyclohexyl-4-(2,6-dimethylphenyl)pyrazol-1-yl]phenoxy]-9-(4-methoxy-2-pyridinyl)carbazole
CID 153442710
9-(4-cyclohexyl-2-pyridinyl)-2-[3-[(4-cyclohexyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-1H-carbazol-1-ide;platinum(2+)
CID 153421345

Frequently Asked Questions

What is the IUPAC name of 9-(4-cyclopentyl-2-pyridinyl)-2-[3-[(4-methoxy-2-pyridinyl)oxy]phenyl]carbazole?
The IUPAC name of 9-(4-cyclopentyl-2-pyridinyl)-2-[3-[(4-methoxy-2-pyridinyl)oxy]phenyl]carbazole (CID 153421975) is 9-(4-cyclopentyl-2-pyridinyl)-2-[3-[(4-methoxy-2-pyridinyl)oxy]phenyl]carbazole.
What is the SMILES notation for 9-(4-cyclopentyl-2-pyridinyl)-2-[3-[(4-methoxy-2-pyridinyl)oxy]phenyl]carbazole?
The canonical SMILES for 9-(4-cyclopentyl-2-pyridinyl)-2-[3-[(4-methoxy-2-pyridinyl)oxy]phenyl]carbazole is COc1ccnc(Oc2cccc(-c3ccc4c5ccccc5n(-c5cc(C6CCCC6)ccn5)c4c3)c2)c1.
What is the InChIKey of 9-(4-cyclopentyl-2-pyridinyl)-2-[3-[(4-methoxy-2-pyridinyl)oxy]phenyl]carbazole?
The InChIKey is DBSPGZIZHZEKGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H29N3O2/c1-38-27-16-18-36-34(22-27)39-28-10-6-9-24(19-28)25-13-14-30-29-11-4-5-12-31(29)37(32(30)20-25)33-21-26(15-17-35-33)23-7-2-3-8-23/h4-6,9-23H,2-3,7-8H2,1H3.
What are the key properties of 9-(4-cyclopentyl-2-pyridinyl)-2-[3-[(4-methoxy-2-pyridinyl)oxy]phenyl]carbazole?
9-(4-cyclopentyl-2-pyridinyl)-2-[3-[(4-methoxy-2-pyridinyl)oxy]phenyl]carbazole has a molecular weight of 511.63 g/mol, XLogP of 8.70, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(4-cyclopentyl-2-pyridinyl)-2-[3-[(4-methoxy-2-pyridinyl)oxy]phenyl]carbazole is sourced from PubChem (CID 153421975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).