1-(4-methoxyphenyl)-2-morpholin-4-yl-2-phenylethanone;hydrochloride

C19H22ClNO3 — CID 6603132

IUPAC1-(4-methoxyphenyl)-2-morpholin-4-yl-2-phenylethanone;hydrochloride
SMILESCOc1ccc(C(=O)C(c2ccccc2)N2CCOCC2)cc1.Cl
InChIInChI=1S/C19H21NO3.ClH/c1-22-17-9-7-16(8-10-17)19(21)18(15-5-3-2-4-6-15)20-11-13-23-14-12-20;/h2-10,18H,11-14H2,1H3;1H
InChIKeyIKPZBMQZEJFWHU-UHFFFAOYSA-N
MW347.84 g/mol
LogP3.37
Rot. Bonds5

About 1-(4-methoxyphenyl)-2-morpholin-4-yl-2-phenylethanone;hydrochloride

1-(4-methoxyphenyl)-2-morpholin-4-yl-2-phenylethanone;hydrochloride (PubChem CID 6603132) has the molecular formula C19H22ClNO3 and a molecular weight of 347.84 g/mol. Its IUPAC name is 1-(4-methoxyphenyl)-2-morpholin-4-yl-2-phenylethanone;hydrochloride.

Molecular Properties

Compound Name1-(4-methoxyphenyl)-2-morpholin-4-yl-2-phenylethanone;hydrochloride
PubChem CID6603132
Molecular FormulaC19H22ClNO3
Molecular Weight347.84 g/mol
Exact Mass347.13
IUPAC Name1-(4-methoxyphenyl)-2-morpholin-4-yl-2-phenylethanone;hydrochloride
SMILESCOc1ccc(C(=O)C(c2ccccc2)N2CCOCC2)cc1.Cl
InChIInChI=1S/C19H21NO3.ClH/c1-22-17-9-7-16(8-10-17)19(21)18(15-5-3-2-4-6-15)20-11-13-23-14-12-20;/h2-10,18H,11-14H2,1H3;1H
InChIKeyIKPZBMQZEJFWHU-UHFFFAOYSA-N
XLogP3.37
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.84
LogP ≤ 53.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxyphenyl)-2-morpholin-4-yl-2-phenylethanone;hydrochloride?
The IUPAC name of 1-(4-methoxyphenyl)-2-morpholin-4-yl-2-phenylethanone;hydrochloride (CID 6603132) is 1-(4-methoxyphenyl)-2-morpholin-4-yl-2-phenylethanone;hydrochloride.
What is the SMILES notation for 1-(4-methoxyphenyl)-2-morpholin-4-yl-2-phenylethanone;hydrochloride?
The canonical SMILES for 1-(4-methoxyphenyl)-2-morpholin-4-yl-2-phenylethanone;hydrochloride is COc1ccc(C(=O)C(c2ccccc2)N2CCOCC2)cc1.Cl.
What is the InChIKey of 1-(4-methoxyphenyl)-2-morpholin-4-yl-2-phenylethanone;hydrochloride?
The InChIKey is IKPZBMQZEJFWHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21NO3.ClH/c1-22-17-9-7-16(8-10-17)19(21)18(15-5-3-2-4-6-15)20-11-13-23-14-12-20;/h2-10,18H,11-14H2,1H3;1H.
What are the key properties of 1-(4-methoxyphenyl)-2-morpholin-4-yl-2-phenylethanone;hydrochloride?
1-(4-methoxyphenyl)-2-morpholin-4-yl-2-phenylethanone;hydrochloride has a molecular weight of 347.84 g/mol, XLogP of 3.37, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxyphenyl)-2-morpholin-4-yl-2-phenylethanone;hydrochloride is sourced from PubChem (CID 6603132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).