1-[2,4,6-tri(propan-2-yl)phenyl]-9H-carbazole

C27H31N — CID 175005160

IUPAC1-[2,4,6-tri(propan-2-yl)phenyl]-9H-carbazole
SMILESCC(C)c1cc(C(C)C)c(-c2cccc3c2[nH]c2ccccc23)c(C(C)C)c1
InChIInChI=1S/C27H31N/c1-16(2)19-14-23(17(3)4)26(24(15-19)18(5)6)22-12-9-11-21-20-10-7-8-13-25(20)28-27(21)22/h7-18,28H,1-6H3
InChIKeyPUUMQYPMCUQCTI-UHFFFAOYSA-N
MW369.55 g/mol
LogP8.36
Rot. Bonds4

About 1-[2,4,6-tri(propan-2-yl)phenyl]-9H-carbazole

1-[2,4,6-tri(propan-2-yl)phenyl]-9H-carbazole (PubChem CID 175005160) has the molecular formula C27H31N and a molecular weight of 369.55 g/mol. Its IUPAC name is 1-[2,4,6-tri(propan-2-yl)phenyl]-9H-carbazole.

Molecular Properties

Compound Name1-[2,4,6-tri(propan-2-yl)phenyl]-9H-carbazole
PubChem CID175005160
Molecular FormulaC27H31N
Molecular Weight369.55 g/mol
Exact Mass369.25
IUPAC Name1-[2,4,6-tri(propan-2-yl)phenyl]-9H-carbazole
SMILESCC(C)c1cc(C(C)C)c(-c2cccc3c2[nH]c2ccccc23)c(C(C)C)c1
InChIInChI=1S/C27H31N/c1-16(2)19-14-23(17(3)4)26(24(15-19)18(5)6)22-12-9-11-21-20-10-7-8-13-25(20)28-27(21)22/h7-18,28H,1-6H3
InChIKeyPUUMQYPMCUQCTI-UHFFFAOYSA-N
XLogP8.36
TPSA15.79 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500369.55
LogP ≤ 58.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

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Related Compounds

1-[2-(9H-carbazol-1-yl)phenyl]-9H-carbazole
CID 66618059
1-[4-[4-[4-[4-(9H-carbazol-1-yl)phenyl]phenyl]phenyl]phenyl]-9H-carbazole
CID 175958773
tetrakis([2,6-bis[2,4,6-tri(propan-2-yl)phenyl]phenyl]-diphenylphosphanium);bis(palladium)
CID 175358759
1-(2-propan-2-ylphenyl)-9H-pyrido[3,4-b]indole
CID 150354253
1-[4-[4-(9H-carbazol-1-yl)-2-methylphenyl]-3-methylphenyl]-9H-carbazole
CID 159544666
1-[2,3,6-tris(9H-carbazol-1-yl)-4-pyridinyl]-9H-carbazole
CID 154262736
9H-carbazol-1-yl(phenyl)methanamine
CID 57120727
[2-(9H-carbazol-1-yl)phenyl]boronic acid
CID 66887079
1-(2-ethoxyphenyl)-9H-carbazole
CID 175136892
2-(4-phenylphenyl)-1,3,5-tri(propan-2-yl)benzene
CID 151062491
1-fluoranthen-3-yl-9H-carbazole
CID 142752993
2-(9H-carbazol-1-yl)-N,N-bis[2-(9H-carbazol-1-yl)phenyl]aniline
CID 68812374

Frequently Asked Questions

What is the IUPAC name of 1-[2,4,6-tri(propan-2-yl)phenyl]-9H-carbazole?
The IUPAC name of 1-[2,4,6-tri(propan-2-yl)phenyl]-9H-carbazole (CID 175005160) is 1-[2,4,6-tri(propan-2-yl)phenyl]-9H-carbazole.
What is the SMILES notation for 1-[2,4,6-tri(propan-2-yl)phenyl]-9H-carbazole?
The canonical SMILES for 1-[2,4,6-tri(propan-2-yl)phenyl]-9H-carbazole is CC(C)c1cc(C(C)C)c(-c2cccc3c2[nH]c2ccccc23)c(C(C)C)c1.
What is the InChIKey of 1-[2,4,6-tri(propan-2-yl)phenyl]-9H-carbazole?
The InChIKey is PUUMQYPMCUQCTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H31N/c1-16(2)19-14-23(17(3)4)26(24(15-19)18(5)6)22-12-9-11-21-20-10-7-8-13-25(20)28-27(21)22/h7-18,28H,1-6H3.
What are the key properties of 1-[2,4,6-tri(propan-2-yl)phenyl]-9H-carbazole?
1-[2,4,6-tri(propan-2-yl)phenyl]-9H-carbazole has a molecular weight of 369.55 g/mol, XLogP of 8.36, 4 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2,4,6-tri(propan-2-yl)phenyl]-9H-carbazole is sourced from PubChem (CID 175005160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).