6-methyl-1-morpholin-4-yl-2,3-diphenylheptan-3-ol;hydrochloride

C24H34ClNO2 — CID 24747974

IUPAC6-methyl-1-morpholin-4-yl-2,3-diphenylheptan-3-ol;hydrochloride
SMILESCC(C)CCC(O)(c1ccccc1)C(CN1CCOCC1)c1ccccc1.Cl
InChIInChI=1S/C24H33NO2.ClH/c1-20(2)13-14-24(26,22-11-7-4-8-12-22)23(21-9-5-3-6-10-21)19-25-15-17-27-18-16-25;/h3-12,20,23,26H,13-19H2,1-2H3;1H
InChIKeyLZPIDHGYMLOGMN-UHFFFAOYSA-N
MW403.99 g/mol
LogP4.85
Rot. Bonds8

About 6-methyl-1-morpholin-4-yl-2,3-diphenylheptan-3-ol;hydrochloride

6-methyl-1-morpholin-4-yl-2,3-diphenylheptan-3-ol;hydrochloride (PubChem CID 24747974) has the molecular formula C24H34ClNO2 and a molecular weight of 403.99 g/mol. Its IUPAC name is 6-methyl-1-morpholin-4-yl-2,3-diphenylheptan-3-ol;hydrochloride.

Molecular Properties

Compound Name6-methyl-1-morpholin-4-yl-2,3-diphenylheptan-3-ol;hydrochloride
PubChem CID24747974
Molecular FormulaC24H34ClNO2
Molecular Weight403.99 g/mol
Exact Mass403.23
IUPAC Name6-methyl-1-morpholin-4-yl-2,3-diphenylheptan-3-ol;hydrochloride
SMILESCC(C)CCC(O)(c1ccccc1)C(CN1CCOCC1)c1ccccc1.Cl
InChIInChI=1S/C24H33NO2.ClH/c1-20(2)13-14-24(26,22-11-7-4-8-12-22)23(21-9-5-3-6-10-21)19-25-15-17-27-18-16-25;/h3-12,20,23,26H,13-19H2,1-2H3;1H
InChIKeyLZPIDHGYMLOGMN-UHFFFAOYSA-N
XLogP4.85
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500403.99
LogP ≤ 54.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-1-morpholin-4-yl-2,3-diphenylheptan-3-ol;hydrochloride?
The IUPAC name of 6-methyl-1-morpholin-4-yl-2,3-diphenylheptan-3-ol;hydrochloride (CID 24747974) is 6-methyl-1-morpholin-4-yl-2,3-diphenylheptan-3-ol;hydrochloride.
What is the SMILES notation for 6-methyl-1-morpholin-4-yl-2,3-diphenylheptan-3-ol;hydrochloride?
The canonical SMILES for 6-methyl-1-morpholin-4-yl-2,3-diphenylheptan-3-ol;hydrochloride is CC(C)CCC(O)(c1ccccc1)C(CN1CCOCC1)c1ccccc1.Cl.
What is the InChIKey of 6-methyl-1-morpholin-4-yl-2,3-diphenylheptan-3-ol;hydrochloride?
The InChIKey is LZPIDHGYMLOGMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H33NO2.ClH/c1-20(2)13-14-24(26,22-11-7-4-8-12-22)23(21-9-5-3-6-10-21)19-25-15-17-27-18-16-25;/h3-12,20,23,26H,13-19H2,1-2H3;1H.
What are the key properties of 6-methyl-1-morpholin-4-yl-2,3-diphenylheptan-3-ol;hydrochloride?
6-methyl-1-morpholin-4-yl-2,3-diphenylheptan-3-ol;hydrochloride has a molecular weight of 403.99 g/mol, XLogP of 4.85, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-1-morpholin-4-yl-2,3-diphenylheptan-3-ol;hydrochloride is sourced from PubChem (CID 24747974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).