1-(4-chlorophenyl)-3-morpholin-4-yl-1-phenylpropan-1-ol

C19H22ClNO2 — CID 4072683

IUPAC1-(4-chlorophenyl)-3-morpholin-4-yl-1-phenylpropan-1-ol
SMILESOC(CCN1CCOCC1)(c1ccccc1)c1ccc(Cl)cc1
InChIInChI=1S/C19H22ClNO2/c20-18-8-6-17(7-9-18)19(22,16-4-2-1-3-5-16)10-11-21-12-14-23-15-13-21/h1-9,22H,10-15H2
InChIKeyLHWCWUJAYYNBCH-UHFFFAOYSA-N
MW331.84 g/mol
LogP3.30
Rot. Bonds5

About 1-(4-chlorophenyl)-3-morpholin-4-yl-1-phenylpropan-1-ol

1-(4-chlorophenyl)-3-morpholin-4-yl-1-phenylpropan-1-ol (PubChem CID 4072683) has the molecular formula C19H22ClNO2 and a molecular weight of 331.84 g/mol. Its IUPAC name is 1-(4-chlorophenyl)-3-morpholin-4-yl-1-phenylpropan-1-ol.

Molecular Properties

Compound Name1-(4-chlorophenyl)-3-morpholin-4-yl-1-phenylpropan-1-ol
PubChem CID4072683
Molecular FormulaC19H22ClNO2
Molecular Weight331.84 g/mol
Exact Mass331.13
IUPAC Name1-(4-chlorophenyl)-3-morpholin-4-yl-1-phenylpropan-1-ol
SMILESOC(CCN1CCOCC1)(c1ccccc1)c1ccc(Cl)cc1
InChIInChI=1S/C19H22ClNO2/c20-18-8-6-17(7-9-18)19(22,16-4-2-1-3-5-16)10-11-21-12-14-23-15-13-21/h1-9,22H,10-15H2
InChIKeyLHWCWUJAYYNBCH-UHFFFAOYSA-N
XLogP3.30
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.84
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-chlorophenyl)-4-morpholin-4-yl-1-phenylbutan-2-ol
CID 23940284
2-(4-chlorophenyl)-4-morpholin-4-yl-1-phenylbutan-2-ol;hydrochloride
CID 163342753
(1S)-1-(4-butoxyphenyl)-3-morpholin-4-yl-1-phenylpropan-1-ol
CID 7128599
3-[4-[(4-chlorophenyl)methyl]-1,4-diazepan-1-yl]-1,1-diphenylpropan-1-ol
CID 23441029
(3R)-3-(4-chlorophenyl)-6-methyl-1-morpholin-4-ylheptan-3-ol
CID 34686638
(1R)-1-(4-chlorophenyl)-1-phenylpropane-1,3-diol
CID 71352218
1-(4-tert-butylphenyl)-4-morpholin-4-yl-2-phenylbutan-2-ol
CID 134093965
4-morpholin-4-yl-2,2-diphenylbutanamide
CID 24840208
2-ethyl-4-morpholin-4-yl-2-phenylbutanamide
CID 18114
(1S,2R)-2-(4-chlorophenyl)-1-(4-ethoxyphenyl)-3-morpholin-4-yl-1-phenylpropan-1-ol
CID 29184647
(1S,2R)-2-(4-chlorophenyl)-1-(4-methoxyphenyl)-3-morpholin-4-yl-1-phenylpropan-1-ol
CID 28952661
1-(2,3,4,5,6-pentadeuteriophenyl)-1-phenyl-3-piperidin-1-ylpropan-1-ol
CID 163322578

Frequently Asked Questions

What is the IUPAC name of 1-(4-chlorophenyl)-3-morpholin-4-yl-1-phenylpropan-1-ol?
The IUPAC name of 1-(4-chlorophenyl)-3-morpholin-4-yl-1-phenylpropan-1-ol (CID 4072683) is 1-(4-chlorophenyl)-3-morpholin-4-yl-1-phenylpropan-1-ol.
What is the SMILES notation for 1-(4-chlorophenyl)-3-morpholin-4-yl-1-phenylpropan-1-ol?
The canonical SMILES for 1-(4-chlorophenyl)-3-morpholin-4-yl-1-phenylpropan-1-ol is OC(CCN1CCOCC1)(c1ccccc1)c1ccc(Cl)cc1.
What is the InChIKey of 1-(4-chlorophenyl)-3-morpholin-4-yl-1-phenylpropan-1-ol?
The InChIKey is LHWCWUJAYYNBCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22ClNO2/c20-18-8-6-17(7-9-18)19(22,16-4-2-1-3-5-16)10-11-21-12-14-23-15-13-21/h1-9,22H,10-15H2.
What are the key properties of 1-(4-chlorophenyl)-3-morpholin-4-yl-1-phenylpropan-1-ol?
1-(4-chlorophenyl)-3-morpholin-4-yl-1-phenylpropan-1-ol has a molecular weight of 331.84 g/mol, XLogP of 3.30, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-chlorophenyl)-3-morpholin-4-yl-1-phenylpropan-1-ol is sourced from PubChem (CID 4072683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).