4-ethoxy-5-methyl-2,2-diphenylpyrrole

C19H19NO — CID 11065745

IUPAC4-ethoxy-5-methyl-2,2-diphenylpyrrole
SMILESCCOC1=CC(c2ccccc2)(c2ccccc2)N=C1C
InChIInChI=1S/C19H19NO/c1-3-21-18-14-19(20-15(18)2,16-10-6-4-7-11-16)17-12-8-5-9-13-17/h4-14H,3H2,1-2H3
InChIKeyUYZWLQFZQPXVKU-UHFFFAOYSA-N
MW277.37 g/mol
LogP4.33
Rot. Bonds4

About 4-ethoxy-5-methyl-2,2-diphenylpyrrole

4-ethoxy-5-methyl-2,2-diphenylpyrrole (PubChem CID 11065745) has the molecular formula C19H19NO and a molecular weight of 277.37 g/mol. Its IUPAC name is 4-ethoxy-5-methyl-2,2-diphenylpyrrole.

Molecular Properties

Compound Name4-ethoxy-5-methyl-2,2-diphenylpyrrole
PubChem CID11065745
Molecular FormulaC19H19NO
Molecular Weight277.37 g/mol
Exact Mass277.15
IUPAC Name4-ethoxy-5-methyl-2,2-diphenylpyrrole
SMILESCCOC1=CC(c2ccccc2)(c2ccccc2)N=C1C
InChIInChI=1S/C19H19NO/c1-3-21-18-14-19(20-15(18)2,16-10-6-4-7-11-16)17-12-8-5-9-13-17/h4-14H,3H2,1-2H3
InChIKeyUYZWLQFZQPXVKU-UHFFFAOYSA-N
XLogP4.33
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 54.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-Ethoxy-2,2,5-triphenylpyrrole
CID 102457372
(4S)-6-(fluoromethyl)-2,4-dimethyl-4-(3-methylphenyl)-1,3-oxazine
CID 144465118
5-Ethoxy-2,2,3-triphenylpyrrole
CID 102457373
5-Methyl-2,2-diphenyl-3,4-dihydropyrrole
CID 134964625
2-Cyclopropyl-3-ethoxy-2,5-diphenylpyrrole
CID 11066645
5-Tert-butyl-3-ethoxy-2,2-diphenylpyrrole
CID 11109980
2,2-Dibenzyl-4-methoxybenzimidazole
CID 20537810
N-[(1S)-1-phenylethyl]furan-3-imine
CID 22870124
N-benzyl-2,6-dimethyl-2,3-dihydropyran-4-imine
CID 91047556
2-Butyl-4-hexoxy-2-phenylpyrrole
CID 174431210
2-Methyl-2,5-diphenyl-3,4-dihydropyrrole
CID 10513929
3-methoxy-3-methyl-N-(2-phenylpropan-2-yl)butan-2-imine
CID 10823548

Frequently Asked Questions

What is the IUPAC name of 4-ethoxy-5-methyl-2,2-diphenylpyrrole?
The IUPAC name of 4-ethoxy-5-methyl-2,2-diphenylpyrrole (CID 11065745) is 4-ethoxy-5-methyl-2,2-diphenylpyrrole.
What is the SMILES notation for 4-ethoxy-5-methyl-2,2-diphenylpyrrole?
The canonical SMILES for 4-ethoxy-5-methyl-2,2-diphenylpyrrole is CCOC1=CC(c2ccccc2)(c2ccccc2)N=C1C.
What is the InChIKey of 4-ethoxy-5-methyl-2,2-diphenylpyrrole?
The InChIKey is UYZWLQFZQPXVKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19NO/c1-3-21-18-14-19(20-15(18)2,16-10-6-4-7-11-16)17-12-8-5-9-13-17/h4-14H,3H2,1-2H3.
What are the key properties of 4-ethoxy-5-methyl-2,2-diphenylpyrrole?
4-ethoxy-5-methyl-2,2-diphenylpyrrole has a molecular weight of 277.37 g/mol, XLogP of 4.33, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-5-methyl-2,2-diphenylpyrrole is sourced from PubChem (CID 11065745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).