1-(2-morpholin-4-ylethyl)-3-phenyl-3H-indol-2-one;hydrochloride

C20H23ClN2O2 — CID 3039296

IUPAC1-(2-morpholin-4-ylethyl)-3-phenyl-3H-indol-2-one;hydrochloride
SMILESCl.O=C1C(c2ccccc2)c2ccccc2N1CCN1CCOCC1
InChIInChI=1S/C20H22N2O2.ClH/c23-20-19(16-6-2-1-3-7-16)17-8-4-5-9-18(17)22(20)11-10-21-12-14-24-15-13-21;/h1-9,19H,10-15H2;1H
InChIKeySEVYKBLBAPWVDG-UHFFFAOYSA-N
MW358.87 g/mol
LogP2.92
Rot. Bonds4

About 1-(2-morpholin-4-ylethyl)-3-phenyl-3H-indol-2-one;hydrochloride

1-(2-morpholin-4-ylethyl)-3-phenyl-3H-indol-2-one;hydrochloride (PubChem CID 3039296) has the molecular formula C20H23ClN2O2 and a molecular weight of 358.87 g/mol. Its IUPAC name is 1-(2-morpholin-4-ylethyl)-3-phenyl-3H-indol-2-one;hydrochloride.

Molecular Properties

Compound Name1-(2-morpholin-4-ylethyl)-3-phenyl-3H-indol-2-one;hydrochloride
PubChem CID3039296
Molecular FormulaC20H23ClN2O2
Molecular Weight358.87 g/mol
Exact Mass358.14
IUPAC Name1-(2-morpholin-4-ylethyl)-3-phenyl-3H-indol-2-one;hydrochloride
SMILESCl.O=C1C(c2ccccc2)c2ccccc2N1CCN1CCOCC1
InChIInChI=1S/C20H22N2O2.ClH/c23-20-19(16-6-2-1-3-7-16)17-8-4-5-9-18(17)22(20)11-10-21-12-14-24-15-13-21;/h1-9,19H,10-15H2;1H
InChIKeySEVYKBLBAPWVDG-UHFFFAOYSA-N
XLogP2.92
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.87
LogP ≤ 52.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(2-morpholin-4-ylethyl)-3-phenyl-3H-indol-2-one;hydrochloride?
The IUPAC name of 1-(2-morpholin-4-ylethyl)-3-phenyl-3H-indol-2-one;hydrochloride (CID 3039296) is 1-(2-morpholin-4-ylethyl)-3-phenyl-3H-indol-2-one;hydrochloride.
What is the SMILES notation for 1-(2-morpholin-4-ylethyl)-3-phenyl-3H-indol-2-one;hydrochloride?
The canonical SMILES for 1-(2-morpholin-4-ylethyl)-3-phenyl-3H-indol-2-one;hydrochloride is Cl.O=C1C(c2ccccc2)c2ccccc2N1CCN1CCOCC1.
What is the InChIKey of 1-(2-morpholin-4-ylethyl)-3-phenyl-3H-indol-2-one;hydrochloride?
The InChIKey is SEVYKBLBAPWVDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N2O2.ClH/c23-20-19(16-6-2-1-3-7-16)17-8-4-5-9-18(17)22(20)11-10-21-12-14-24-15-13-21;/h1-9,19H,10-15H2;1H.
What are the key properties of 1-(2-morpholin-4-ylethyl)-3-phenyl-3H-indol-2-one;hydrochloride?
1-(2-morpholin-4-ylethyl)-3-phenyl-3H-indol-2-one;hydrochloride has a molecular weight of 358.87 g/mol, XLogP of 2.92, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-morpholin-4-ylethyl)-3-phenyl-3H-indol-2-one;hydrochloride is sourced from PubChem (CID 3039296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).