5-(2-phenoxyphenyl)-3,4-dihydro-2H-pyrrole

C16H15NO — CID 22084810

IUPAC5-(2-phenoxyphenyl)-3,4-dihydro-2H-pyrrole
SMILESc1ccc(Oc2ccccc2C2=NCCC2)cc1
InChIInChI=1S/C16H15NO/c1-2-7-13(8-3-1)18-16-11-5-4-9-14(16)15-10-6-12-17-15/h1-5,7-9,11H,6,10,12H2
InChIKeyCZXHMRGFZONMIH-UHFFFAOYSA-N
MW237.30 g/mol
LogP4.06
Rot. Bonds3

About 5-(2-phenoxyphenyl)-3,4-dihydro-2H-pyrrole

5-(2-phenoxyphenyl)-3,4-dihydro-2H-pyrrole (PubChem CID 22084810) has the molecular formula C16H15NO and a molecular weight of 237.30 g/mol. Its IUPAC name is 5-(2-phenoxyphenyl)-3,4-dihydro-2H-pyrrole.

Molecular Properties

Compound Name5-(2-phenoxyphenyl)-3,4-dihydro-2H-pyrrole
PubChem CID22084810
Molecular FormulaC16H15NO
Molecular Weight237.30 g/mol
Exact Mass237.12
IUPAC Name5-(2-phenoxyphenyl)-3,4-dihydro-2H-pyrrole
SMILESc1ccc(Oc2ccccc2C2=NCCC2)cc1
InChIInChI=1S/C16H15NO/c1-2-7-13(8-3-1)18-16-11-5-4-9-14(16)15-10-6-12-17-15/h1-5,7-9,11H,6,10,12H2
InChIKeyCZXHMRGFZONMIH-UHFFFAOYSA-N
XLogP4.06
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.30
LogP ≤ 54.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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N-(5-chloro-2-phenoxyphenyl)-3,4-dihydro-2H-pyrrol-5-amine
CID 2101081
2-chloro-4-(2-phenoxyphenyl)pyrimidine
CID 24901901
ethane;1-methyl-2-phenoxybenzene
CID 90950955
2-(2-phenoxyphenyl)furan
CID 173223033
6-(2-phenoxyphenyl)pyridin-3-amine
CID 68649369
2-(2-phenoxyphenyl)-6-phenylbenzenethiol
CID 19734018
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[4-(2-phenoxyphenyl)triazol-1-yl]methanol
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CID 166389025

Frequently Asked Questions

What is the IUPAC name of 5-(2-phenoxyphenyl)-3,4-dihydro-2H-pyrrole?
The IUPAC name of 5-(2-phenoxyphenyl)-3,4-dihydro-2H-pyrrole (CID 22084810) is 5-(2-phenoxyphenyl)-3,4-dihydro-2H-pyrrole.
What is the SMILES notation for 5-(2-phenoxyphenyl)-3,4-dihydro-2H-pyrrole?
The canonical SMILES for 5-(2-phenoxyphenyl)-3,4-dihydro-2H-pyrrole is c1ccc(Oc2ccccc2C2=NCCC2)cc1.
What is the InChIKey of 5-(2-phenoxyphenyl)-3,4-dihydro-2H-pyrrole?
The InChIKey is CZXHMRGFZONMIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15NO/c1-2-7-13(8-3-1)18-16-11-5-4-9-14(16)15-10-6-12-17-15/h1-5,7-9,11H,6,10,12H2.
What are the key properties of 5-(2-phenoxyphenyl)-3,4-dihydro-2H-pyrrole?
5-(2-phenoxyphenyl)-3,4-dihydro-2H-pyrrole has a molecular weight of 237.30 g/mol, XLogP of 4.06, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-phenoxyphenyl)-3,4-dihydro-2H-pyrrole is sourced from PubChem (CID 22084810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).