9-(2-methyl-6-phenylpyrimidin-4-yl)carbazole

C23H17N3 — CID 145299185

IUPAC9-(2-methyl-6-phenylpyrimidin-4-yl)carbazole
SMILESCc1nc(-c2ccccc2)cc(-n2c3ccccc3c3ccccc32)n1
InChIInChI=1S/C23H17N3/c1-16-24-20(17-9-3-2-4-10-17)15-23(25-16)26-21-13-7-5-11-18(21)19-12-6-8-14-22(19)26/h2-15H,1H3
InChIKeyPNKGVYQBJBPWRV-UHFFFAOYSA-N
MW335.41 g/mol
LogP5.55
Rot. Bonds2

About 9-(2-methyl-6-phenylpyrimidin-4-yl)carbazole

9-(2-methyl-6-phenylpyrimidin-4-yl)carbazole (PubChem CID 145299185) has the molecular formula C23H17N3 and a molecular weight of 335.41 g/mol. Its IUPAC name is 9-(2-methyl-6-phenylpyrimidin-4-yl)carbazole.

Molecular Properties

Compound Name9-(2-methyl-6-phenylpyrimidin-4-yl)carbazole
PubChem CID145299185
Molecular FormulaC23H17N3
Molecular Weight335.41 g/mol
Exact Mass335.14
IUPAC Name9-(2-methyl-6-phenylpyrimidin-4-yl)carbazole
SMILESCc1nc(-c2ccccc2)cc(-n2c3ccccc3c3ccccc32)n1
InChIInChI=1S/C23H17N3/c1-16-24-20(17-9-3-2-4-10-17)15-23(25-16)26-21-13-7-5-11-18(21)19-12-6-8-14-22(19)26/h2-15H,1H3
InChIKeyPNKGVYQBJBPWRV-UHFFFAOYSA-N
XLogP5.55
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500335.41
LogP ≤ 55.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-(4-carbazol-9-yl-6-phenylpyrimidin-2-yl)-9-(2,6-diphenylpyrimidin-4-yl)carbazole
CID 146572869
9-[2-carbazol-9-yl-6-[4-[3-[4-[2,6-di(carbazol-9-yl)pyrimidin-4-yl]phenyl]-5-(4-phenylphenyl)phenyl]phenyl]pyrimidin-4-yl]carbazole
CID 58943683
5-(2,6-diphenylpyrimidin-4-yl)-7-phenylindolo[2,3-b]carbazole
CID 134168850
9-(4,6-diphenyl-2-pyridinyl)-3-methylcarbazole;ethane
CID 144875865
[9-(2,6-diphenylpyrimidin-4-yl)carbazol-3-yl]boronic acid
CID 140873197
9-[2-(21-pentacyclo[12.8.0.02,7.08,13.015,20]docosa-1(14),2,4,6,8,10,12,15,17,19,21-undecaenyl)-6-phenylpyrimidin-4-yl]carbazole
CID 145299212
9-[6-carbazol-9-yl-2-[4,6-di(carbazol-9-yl)pyrimidin-2-yl]pyrimidin-4-yl]-3-[3-[2-(4,6-diphenylpyrimidin-2-yl)-6-phenylpyrimidin-4-yl]phenyl]carbazole
CID 146379780
4-carbazol-9-yl-6-phenylpyrimidine-2-sulfinic acid
CID 170902264
5-(2,6-diphenylpyrimidin-4-yl)-7-phenylindolo[2,3-b]carbazole;7-phenyl-5-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]indolo[2,3-b]carbazole
CID 158545960
[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]boronic acid
CID 140890322
5,7-bis(6-phenyl-2-pyridinyl)indolo[2,3-b]carbazole
CID 58038356
9-[2-carbazol-9-yl-6-[3-[3-[3-[2,6-di(carbazol-9-yl)pyrimidin-4-yl]phenyl]-5-phenylphenyl]phenyl]pyrimidin-4-yl]carbazole
CID 58943440

Frequently Asked Questions

What is the IUPAC name of 9-(2-methyl-6-phenylpyrimidin-4-yl)carbazole?
The IUPAC name of 9-(2-methyl-6-phenylpyrimidin-4-yl)carbazole (CID 145299185) is 9-(2-methyl-6-phenylpyrimidin-4-yl)carbazole.
What is the SMILES notation for 9-(2-methyl-6-phenylpyrimidin-4-yl)carbazole?
The canonical SMILES for 9-(2-methyl-6-phenylpyrimidin-4-yl)carbazole is Cc1nc(-c2ccccc2)cc(-n2c3ccccc3c3ccccc32)n1.
What is the InChIKey of 9-(2-methyl-6-phenylpyrimidin-4-yl)carbazole?
The InChIKey is PNKGVYQBJBPWRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H17N3/c1-16-24-20(17-9-3-2-4-10-17)15-23(25-16)26-21-13-7-5-11-18(21)19-12-6-8-14-22(19)26/h2-15H,1H3.
What are the key properties of 9-(2-methyl-6-phenylpyrimidin-4-yl)carbazole?
9-(2-methyl-6-phenylpyrimidin-4-yl)carbazole has a molecular weight of 335.41 g/mol, XLogP of 5.55, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(2-methyl-6-phenylpyrimidin-4-yl)carbazole is sourced from PubChem (CID 145299185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).