5-phenylmethoxy-2-pyridin-2-yl-1H-indole

C20H16N2O — CID 44556831

IUPAC5-phenylmethoxy-2-pyridin-2-yl-1H-indole
SMILESc1ccc(COc2ccc3[nH]c(-c4ccccn4)cc3c2)cc1
InChIInChI=1S/C20H16N2O/c1-2-6-15(7-3-1)14-23-17-9-10-18-16(12-17)13-20(22-18)19-8-4-5-11-21-19/h1-13,22H,14H2
InChIKeyFDFMZPUTUONXEL-UHFFFAOYSA-N
MW300.36 g/mol
LogP4.81
Rot. Bonds4

About 5-phenylmethoxy-2-pyridin-2-yl-1H-indole

5-phenylmethoxy-2-pyridin-2-yl-1H-indole (PubChem CID 44556831) has the molecular formula C20H16N2O and a molecular weight of 300.36 g/mol. Its IUPAC name is 5-phenylmethoxy-2-pyridin-2-yl-1H-indole.

Molecular Properties

Compound Name5-phenylmethoxy-2-pyridin-2-yl-1H-indole
PubChem CID44556831
Molecular FormulaC20H16N2O
Molecular Weight300.36 g/mol
Exact Mass300.13
IUPAC Name5-phenylmethoxy-2-pyridin-2-yl-1H-indole
SMILESc1ccc(COc2ccc3[nH]c(-c4ccccn4)cc3c2)cc1
InChIInChI=1S/C20H16N2O/c1-2-6-15(7-3-1)14-23-17-9-10-18-16(12-17)13-20(22-18)19-8-4-5-11-21-19/h1-13,22H,14H2
InChIKeyFDFMZPUTUONXEL-UHFFFAOYSA-N
XLogP4.81
TPSA37.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.36
LogP ≤ 54.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-phenylmethoxy-2-pyridin-2-yl-1H-indole?
The IUPAC name of 5-phenylmethoxy-2-pyridin-2-yl-1H-indole (CID 44556831) is 5-phenylmethoxy-2-pyridin-2-yl-1H-indole.
What is the SMILES notation for 5-phenylmethoxy-2-pyridin-2-yl-1H-indole?
The canonical SMILES for 5-phenylmethoxy-2-pyridin-2-yl-1H-indole is c1ccc(COc2ccc3[nH]c(-c4ccccn4)cc3c2)cc1.
What is the InChIKey of 5-phenylmethoxy-2-pyridin-2-yl-1H-indole?
The InChIKey is FDFMZPUTUONXEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16N2O/c1-2-6-15(7-3-1)14-23-17-9-10-18-16(12-17)13-20(22-18)19-8-4-5-11-21-19/h1-13,22H,14H2.
What are the key properties of 5-phenylmethoxy-2-pyridin-2-yl-1H-indole?
5-phenylmethoxy-2-pyridin-2-yl-1H-indole has a molecular weight of 300.36 g/mol, XLogP of 4.81, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-phenylmethoxy-2-pyridin-2-yl-1H-indole is sourced from PubChem (CID 44556831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).