2-methyl-3-[(2R)-2-methyl-1-azabicyclo[2.2.1]heptan-3-yl]-9-phenylcarbazole

C26H26N2 — CID 137454491

IUPAC2-methyl-3-[(2R)-2-methyl-1-azabicyclo[2.2.1]heptan-3-yl]-9-phenylcarbazole
SMILESCc1cc2c(cc1C1C3CCN(C3)[C@@H]1C)c1ccccc1n2-c1ccccc1
InChIInChI=1S/C26H26N2/c1-17-14-25-23(15-22(17)26-18(2)27-13-12-19(26)16-27)21-10-6-7-11-24(21)28(25)20-8-4-3-5-9-20/h3-11,14-15,18-19,26H,12-13,16H2,1-2H3/t18-,19?,26?/m1/s1
InChIKeySAKFBSADMUMMLH-GDZHNBNXSA-N
MW366.51 g/mol
LogP5.90
Rot. Bonds2

About 2-methyl-3-[(2R)-2-methyl-1-azabicyclo[2.2.1]heptan-3-yl]-9-phenylcarbazole

2-methyl-3-[(2R)-2-methyl-1-azabicyclo[2.2.1]heptan-3-yl]-9-phenylcarbazole (PubChem CID 137454491) has the molecular formula C26H26N2 and a molecular weight of 366.51 g/mol. Its IUPAC name is 2-methyl-3-[(2R)-2-methyl-1-azabicyclo[2.2.1]heptan-3-yl]-9-phenylcarbazole.

Molecular Properties

Compound Name2-methyl-3-[(2R)-2-methyl-1-azabicyclo[2.2.1]heptan-3-yl]-9-phenylcarbazole
PubChem CID137454491
Molecular FormulaC26H26N2
Molecular Weight366.51 g/mol
Exact Mass366.21
IUPAC Name2-methyl-3-[(2R)-2-methyl-1-azabicyclo[2.2.1]heptan-3-yl]-9-phenylcarbazole
SMILESCc1cc2c(cc1C1C3CCN(C3)[C@@H]1C)c1ccccc1n2-c1ccccc1
InChIInChI=1S/C26H26N2/c1-17-14-25-23(15-22(17)26-18(2)27-13-12-19(26)16-27)21-10-6-7-11-24(21)28(25)20-8-4-3-5-9-20/h3-11,14-15,18-19,26H,12-13,16H2,1-2H3/t18-,19?,26?/m1/s1
InChIKeySAKFBSADMUMMLH-GDZHNBNXSA-N
XLogP5.90
TPSA8.17 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500366.51
LogP ≤ 55.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-[(3S)-1,3-dimethyl-2-azabicyclo[2.2.2]octan-2-yl]-2-methyl-9-phenylcarbazole
CID 137454364
3-[(2S)-2,4-dimethyl-1,3-diazabicyclo[2.2.2]octan-3-yl]-2-methyl-9-phenylcarbazole
CID 137454846
2-methyl-9-phenylcarbazole
CID 59552741
(11S)-11-methyl-10-(2-methyl-9-phenylcarbazol-3-yl)-1,10-diazatricyclo[7.2.2.02,7]trideca-2,4,6-triene
CID 137454500
3-(3,4-dimethyl-2-azabicyclo[2.2.1]heptan-2-yl)-2-methyl-9-phenylcarbazole
CID 162296119
3-[(2S)-2,3-dimethyl-4,5-dihydro-2H-1,3-benzodiazepin-1-yl]-2-methyl-9-phenylcarbazole
CID 137454882
2-methyl-9-phenylcarbazole;3-methyl-9-phenylcarbazole
CID 159508303
3-carbazol-9-yl-6-(3-carbazol-9-ylcarbazol-9-yl)-9-phenylcarbazole
CID 146337769
2-carbazol-9-yl-9-phenylcarbazole
CID 118335086
5-phenyl-11-[4-(4-phenylphenyl)phenyl]indolo[3,2-b]carbazole
CID 142356573
2-carbazol-9-yl-5,7-diphenylindolo[2,3-b]carbazole
CID 118504684
2-(3-carbazol-9-ylcarbazol-9-yl)-9-(9-phenylcarbazol-3-yl)carbazole
CID 121274440

Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-[(2R)-2-methyl-1-azabicyclo[2.2.1]heptan-3-yl]-9-phenylcarbazole?
The IUPAC name of 2-methyl-3-[(2R)-2-methyl-1-azabicyclo[2.2.1]heptan-3-yl]-9-phenylcarbazole (CID 137454491) is 2-methyl-3-[(2R)-2-methyl-1-azabicyclo[2.2.1]heptan-3-yl]-9-phenylcarbazole.
What is the SMILES notation for 2-methyl-3-[(2R)-2-methyl-1-azabicyclo[2.2.1]heptan-3-yl]-9-phenylcarbazole?
The canonical SMILES for 2-methyl-3-[(2R)-2-methyl-1-azabicyclo[2.2.1]heptan-3-yl]-9-phenylcarbazole is Cc1cc2c(cc1C1C3CCN(C3)[C@@H]1C)c1ccccc1n2-c1ccccc1.
What is the InChIKey of 2-methyl-3-[(2R)-2-methyl-1-azabicyclo[2.2.1]heptan-3-yl]-9-phenylcarbazole?
The InChIKey is SAKFBSADMUMMLH-GDZHNBNXSA-N. The full InChI is InChI=1S/C26H26N2/c1-17-14-25-23(15-22(17)26-18(2)27-13-12-19(26)16-27)21-10-6-7-11-24(21)28(25)20-8-4-3-5-9-20/h3-11,14-15,18-19,26H,12-13,16H2,1-2H3/t18-,19?,26?/m1/s1.
What are the key properties of 2-methyl-3-[(2R)-2-methyl-1-azabicyclo[2.2.1]heptan-3-yl]-9-phenylcarbazole?
2-methyl-3-[(2R)-2-methyl-1-azabicyclo[2.2.1]heptan-3-yl]-9-phenylcarbazole has a molecular weight of 366.51 g/mol, XLogP of 5.90, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-[(2R)-2-methyl-1-azabicyclo[2.2.1]heptan-3-yl]-9-phenylcarbazole is sourced from PubChem (CID 137454491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).