3,4-diphenyl-1-phenylmethoxypyrrole

C23H19NO — CID 141397574

IUPAC3,4-diphenyl-1-phenylmethoxypyrrole
SMILESc1ccc(COn2cc(-c3ccccc3)c(-c3ccccc3)c2)cc1
InChIInChI=1S/C23H19NO/c1-4-10-19(11-5-1)18-25-24-16-22(20-12-6-2-7-13-20)23(17-24)21-14-8-3-9-15-21/h1-17H,18H2
InChIKeyCEPOBHNWRMAEKV-UHFFFAOYSA-N
MW325.41 g/mol
LogP5.45
Rot. Bonds5

About 3,4-diphenyl-1-phenylmethoxypyrrole

3,4-diphenyl-1-phenylmethoxypyrrole (PubChem CID 141397574) has the molecular formula C23H19NO and a molecular weight of 325.41 g/mol. Its IUPAC name is 3,4-diphenyl-1-phenylmethoxypyrrole.

Molecular Properties

Compound Name3,4-diphenyl-1-phenylmethoxypyrrole
PubChem CID141397574
Molecular FormulaC23H19NO
Molecular Weight325.41 g/mol
Exact Mass325.15
IUPAC Name3,4-diphenyl-1-phenylmethoxypyrrole
SMILESc1ccc(COn2cc(-c3ccccc3)c(-c3ccccc3)c2)cc1
InChIInChI=1S/C23H19NO/c1-4-10-19(11-5-1)18-25-24-16-22(20-12-6-2-7-13-20)23(17-24)21-14-8-3-9-15-21/h1-17H,18H2
InChIKeyCEPOBHNWRMAEKV-UHFFFAOYSA-N
XLogP5.45
TPSA14.16 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500325.41
LogP ≤ 55.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-phenylmethoxypyrrole-3-carbaldehyde
CID 23130676
1-ethyl-4-phenyl-3-phenylmethoxypyrazole
CID 174513301
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CID 174530379
phenoxymethylbenzene;2-phenylphenol
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2-phenyl-5-phenylmethoxyphenol
CID 123808909
CID 66734377
CID 66734377
4-chloro-1-phenylmethoxypyrazole
CID 91619331
1-phenylmethoxyazetidin-3-amine
CID 162036959
1-phenylmethoxy-1,2,4-triazolidine
CID 174937405
1-benzyl-3-phenyl-2-phenylmethoxybenzene
CID 58238649
(3-phenyl-4-phenylmethoxyphenyl)methanol
CID 164896135
4-ethyl-1-phenylmethoxypyrazole
CID 119082094

Frequently Asked Questions

What is the IUPAC name of 3,4-diphenyl-1-phenylmethoxypyrrole?
The IUPAC name of 3,4-diphenyl-1-phenylmethoxypyrrole (CID 141397574) is 3,4-diphenyl-1-phenylmethoxypyrrole.
What is the SMILES notation for 3,4-diphenyl-1-phenylmethoxypyrrole?
The canonical SMILES for 3,4-diphenyl-1-phenylmethoxypyrrole is c1ccc(COn2cc(-c3ccccc3)c(-c3ccccc3)c2)cc1.
What is the InChIKey of 3,4-diphenyl-1-phenylmethoxypyrrole?
The InChIKey is CEPOBHNWRMAEKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19NO/c1-4-10-19(11-5-1)18-25-24-16-22(20-12-6-2-7-13-20)23(17-24)21-14-8-3-9-15-21/h1-17H,18H2.
What are the key properties of 3,4-diphenyl-1-phenylmethoxypyrrole?
3,4-diphenyl-1-phenylmethoxypyrrole has a molecular weight of 325.41 g/mol, XLogP of 5.45, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-diphenyl-1-phenylmethoxypyrrole is sourced from PubChem (CID 141397574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).