9-phenyl-6-(5-pyridin-2-yl-2-pyridinyl)pyrido[2,3-b]indole

C27H18N4 — CID 118403810

IUPAC9-phenyl-6-(5-pyridin-2-yl-2-pyridinyl)pyrido[2,3-b]indole
SMILESc1ccc(-n2c3ccc(-c4ccc(-c5ccccn5)cn4)cc3c3cccnc32)cc1
InChIInChI=1S/C27H18N4/c1-2-7-21(8-3-1)31-26-14-12-19(17-23(26)22-9-6-16-29-27(22)31)25-13-11-20(18-30-25)24-10-4-5-15-28-24/h1-18H
InChIKeyNTVXXAXBXRKXLF-UHFFFAOYSA-N
MW398.47 g/mol
LogP6.30
Rot. Bonds3

About 9-phenyl-6-(5-pyridin-2-yl-2-pyridinyl)pyrido[2,3-b]indole

9-phenyl-6-(5-pyridin-2-yl-2-pyridinyl)pyrido[2,3-b]indole (PubChem CID 118403810) has the molecular formula C27H18N4 and a molecular weight of 398.47 g/mol. Its IUPAC name is 9-phenyl-6-(5-pyridin-2-yl-2-pyridinyl)pyrido[2,3-b]indole.

Molecular Properties

Compound Name9-phenyl-6-(5-pyridin-2-yl-2-pyridinyl)pyrido[2,3-b]indole
PubChem CID118403810
Molecular FormulaC27H18N4
Molecular Weight398.47 g/mol
Exact Mass398.15
IUPAC Name9-phenyl-6-(5-pyridin-2-yl-2-pyridinyl)pyrido[2,3-b]indole
SMILESc1ccc(-n2c3ccc(-c4ccc(-c5ccccn5)cn4)cc3c3cccnc32)cc1
InChIInChI=1S/C27H18N4/c1-2-7-21(8-3-1)31-26-14-12-19(17-23(26)22-9-6-16-29-27(22)31)25-13-11-20(18-30-25)24-10-4-5-15-28-24/h1-18H
InChIKeyNTVXXAXBXRKXLF-UHFFFAOYSA-N
XLogP6.30
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500398.47
LogP ≤ 56.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

6-(5-naphthalen-1-yl-2-pyridinyl)-9-phenylpyrido[2,3-b]indole
CID 118403794
9-(3,5-dipyridin-2-ylphenyl)-6-(9-phenylcarbazol-2-yl)pyrido[2,3-b]indole
CID 118587520
9-phenyl-3-[5-[6-(9-phenylcarbazol-3-yl)-3-pyridinyl]-2-pyridinyl]carbazole
CID 56943928
5,7-diphenyl-2,10-dipyridin-2-ylindolo[2,3-b]carbazole
CID 130417472
9-phenyl-3-[3-[3-(3-pyridin-2-ylphenyl)phenyl]phenyl]carbazole
CID 153423283
9-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]-6-(9-phenylcarbazol-2-yl)pyrido[2,3-b]indole
CID 129221681
3-(9-phenylcarbazol-3-yl)-9-(4-pyridin-2-ylphenyl)carbazole
CID 118967167
9-(3,5-dipyridin-2-ylphenyl)-7-(9-phenylcarbazol-2-yl)pyrido[2,3-b]indole
CID 129221618
9-phenyl-6-(10-pyridin-2-ylanthracen-9-yl)pyrido[2,3-b]indole;2-[10-(9-phenylpyrido[2,3-b]indol-6-yl)anthracen-9-yl]-1,10-phenanthroline;9-phenyl-6-(10-quinolin-2-ylanthracen-9-yl)pyrido[2,3-b]indole
CID 159575994
9-phenyl-3-[4-[6-(4-phenyl-6-pyridin-2-yl-2-pyridinyl)-3-pyridinyl]phenyl]carbazole
CID 164817113
2-[4-(9-phenylpyrido[2,3-b]indol-6-yl)phenyl]-1,10-phenanthroline
CID 118403847
9-[4-(3,5-dipyridin-2-ylphenyl)phenyl]-6-(9-phenylcarbazol-4-yl)pyrido[2,3-b]indole;9-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]-6-(9-phenylcarbazol-4-yl)pyrido[2,3-b]indole
CID 158404712

Frequently Asked Questions

What is the IUPAC name of 9-phenyl-6-(5-pyridin-2-yl-2-pyridinyl)pyrido[2,3-b]indole?
The IUPAC name of 9-phenyl-6-(5-pyridin-2-yl-2-pyridinyl)pyrido[2,3-b]indole (CID 118403810) is 9-phenyl-6-(5-pyridin-2-yl-2-pyridinyl)pyrido[2,3-b]indole.
What is the SMILES notation for 9-phenyl-6-(5-pyridin-2-yl-2-pyridinyl)pyrido[2,3-b]indole?
The canonical SMILES for 9-phenyl-6-(5-pyridin-2-yl-2-pyridinyl)pyrido[2,3-b]indole is c1ccc(-n2c3ccc(-c4ccc(-c5ccccn5)cn4)cc3c3cccnc32)cc1.
What is the InChIKey of 9-phenyl-6-(5-pyridin-2-yl-2-pyridinyl)pyrido[2,3-b]indole?
The InChIKey is NTVXXAXBXRKXLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H18N4/c1-2-7-21(8-3-1)31-26-14-12-19(17-23(26)22-9-6-16-29-27(22)31)25-13-11-20(18-30-25)24-10-4-5-15-28-24/h1-18H.
What are the key properties of 9-phenyl-6-(5-pyridin-2-yl-2-pyridinyl)pyrido[2,3-b]indole?
9-phenyl-6-(5-pyridin-2-yl-2-pyridinyl)pyrido[2,3-b]indole has a molecular weight of 398.47 g/mol, XLogP of 6.30, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 9-phenyl-6-(5-pyridin-2-yl-2-pyridinyl)pyrido[2,3-b]indole is sourced from PubChem (CID 118403810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).