2-phenyl-1-(2,4,6-trimethylphenyl)pyrrole

C19H19N — CID 101477910

IUPAC2-phenyl-1-(2,4,6-trimethylphenyl)pyrrole
SMILESCc1cc(C)c(-n2cccc2-c2ccccc2)c(C)c1
InChIInChI=1S/C19H19N/c1-14-12-15(2)19(16(3)13-14)20-11-7-10-18(20)17-8-5-4-6-9-17/h4-13H,1-3H3
InChIKeyWYQKPMGPYYNVKH-UHFFFAOYSA-N
MW261.37 g/mol
LogP5.07
Rot. Bonds2

About 2-phenyl-1-(2,4,6-trimethylphenyl)pyrrole

2-phenyl-1-(2,4,6-trimethylphenyl)pyrrole (PubChem CID 101477910) has the molecular formula C19H19N and a molecular weight of 261.37 g/mol. Its IUPAC name is 2-phenyl-1-(2,4,6-trimethylphenyl)pyrrole.

Molecular Properties

Compound Name2-phenyl-1-(2,4,6-trimethylphenyl)pyrrole
PubChem CID101477910
Molecular FormulaC19H19N
Molecular Weight261.37 g/mol
Exact Mass261.15
IUPAC Name2-phenyl-1-(2,4,6-trimethylphenyl)pyrrole
SMILESCc1cc(C)c(-n2cccc2-c2ccccc2)c(C)c1
InChIInChI=1S/C19H19N/c1-14-12-15(2)19(16(3)13-14)20-11-7-10-18(20)17-8-5-4-6-9-17/h4-13H,1-3H3
InChIKeyWYQKPMGPYYNVKH-UHFFFAOYSA-N
XLogP5.07
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500261.37
LogP ≤ 55.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-phenyl-2-(2,4,6-trimethylphenyl)pyrrole
CID 102583859
[2-phenyl-1-(2,4,6-trimethylphenyl)imidazol-4-yl] thiocyanate
CID 155646487
1,3-bis(2,4,6-trimethylphenyl)imidazole-2-selone
CID 122228843
1,4-diphenyl-2,3,5,6-tetrakis[4-(2,4,6-trimethylphenyl)phenyl]benzene
CID 135033708
2-[dichloro(phenyl)methyl]-1,3-bis(2,4,6-trimethylphenyl)-2H-imidazole
CID 90751934
1,7-dimethyl-3-phenylindolizine
CID 162349619
(Z)-2-[[1,3-bis(2,4,6-trimethylphenyl)imidazol-2-ylidene]amino]-1-phenylethenol
CID 102498583
1-(3,5-diphenylphenyl)-3-methyl-5-phenylbenzene
CID 123422549
1,2,5-trimethyl-3-phenylbenzene;hydrate
CID 130423762
1,3,5-trimethyl-2-(2-phenylphenyl)benzene
CID 18795387
(4S,5S)-4,5-diphenyl-1-(2-phenylphenyl)-3-(2,4,6-trimethylphenyl)imidazolidine
CID 134942689
1,3-dimethyl-5-phenylbenzene;methane
CID 143325792

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-1-(2,4,6-trimethylphenyl)pyrrole?
The IUPAC name of 2-phenyl-1-(2,4,6-trimethylphenyl)pyrrole (CID 101477910) is 2-phenyl-1-(2,4,6-trimethylphenyl)pyrrole.
What is the SMILES notation for 2-phenyl-1-(2,4,6-trimethylphenyl)pyrrole?
The canonical SMILES for 2-phenyl-1-(2,4,6-trimethylphenyl)pyrrole is Cc1cc(C)c(-n2cccc2-c2ccccc2)c(C)c1.
What is the InChIKey of 2-phenyl-1-(2,4,6-trimethylphenyl)pyrrole?
The InChIKey is WYQKPMGPYYNVKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N/c1-14-12-15(2)19(16(3)13-14)20-11-7-10-18(20)17-8-5-4-6-9-17/h4-13H,1-3H3.
What are the key properties of 2-phenyl-1-(2,4,6-trimethylphenyl)pyrrole?
2-phenyl-1-(2,4,6-trimethylphenyl)pyrrole has a molecular weight of 261.37 g/mol, XLogP of 5.07, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-1-(2,4,6-trimethylphenyl)pyrrole is sourced from PubChem (CID 101477910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).