3-(4-chlorophenyl)-1-morpholin-4-ylheptan-3-ol;hydrochloride

C17H27Cl2NO2 — CID 2984506

IUPAC3-(4-chlorophenyl)-1-morpholin-4-ylheptan-3-ol;hydrochloride
SMILESCCCCC(O)(CCN1CCOCC1)c1ccc(Cl)cc1.Cl
InChIInChI=1S/C17H26ClNO2.ClH/c1-2-3-8-17(20,15-4-6-16(18)7-5-15)9-10-19-11-13-21-14-12-19;/h4-7,20H,2-3,8-14H2,1H3;1H
InChIKeyKKCWAVVBDYZONJ-UHFFFAOYSA-N
MW348.31 g/mol
LogP3.86
Rot. Bonds7

About 3-(4-chlorophenyl)-1-morpholin-4-ylheptan-3-ol;hydrochloride

3-(4-chlorophenyl)-1-morpholin-4-ylheptan-3-ol;hydrochloride (PubChem CID 2984506) has the molecular formula C17H27Cl2NO2 and a molecular weight of 348.31 g/mol. Its IUPAC name is 3-(4-chlorophenyl)-1-morpholin-4-ylheptan-3-ol;hydrochloride.

Molecular Properties

Compound Name3-(4-chlorophenyl)-1-morpholin-4-ylheptan-3-ol;hydrochloride
PubChem CID2984506
Molecular FormulaC17H27Cl2NO2
Molecular Weight348.31 g/mol
Exact Mass347.14
IUPAC Name3-(4-chlorophenyl)-1-morpholin-4-ylheptan-3-ol;hydrochloride
SMILESCCCCC(O)(CCN1CCOCC1)c1ccc(Cl)cc1.Cl
InChIInChI=1S/C17H26ClNO2.ClH/c1-2-3-8-17(20,15-4-6-16(18)7-5-15)9-10-19-11-13-21-14-12-19;/h4-7,20H,2-3,8-14H2,1H3;1H
InChIKeyKKCWAVVBDYZONJ-UHFFFAOYSA-N
XLogP3.86
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.31
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-(4-chlorophenyl)-1-morpholin-4-ylheptan-3-ol;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Cloperastine
CID 2805
Cloperastine Hydrochloride
CID 161104
4-(4-Chlorophenyl)-alpha-(4-fluorophenyl)-4-hydroxy-1-piperidinebutanol
CID 119265
Clofenetamine
CID 71812
Chlorphenoxamine Hydrochloride
CID 11223
Chlophedianol Hydrochloride
CID 83813
Levocloperastine
CID 688420
Clofenciclan
CID 25904
Dihydrohaloperidol, (S)-
CID 16048564
Setastine
CID 43082
1-[1-(4-Chlorophenyl)ethoxy]-3-[2-(2-hydroxyethyl)piperidin-1-yl]propan-2-ol
CID 4799605
1-[(1S,2S)-1-(4-chlorophenyl)-1-hydroxypropan-2-yl]-4-phenylpiperidin-4-ol
CID 10020476

Frequently Asked Questions

What is the IUPAC name of 3-(4-chlorophenyl)-1-morpholin-4-ylheptan-3-ol;hydrochloride?
The IUPAC name of 3-(4-chlorophenyl)-1-morpholin-4-ylheptan-3-ol;hydrochloride (CID 2984506) is 3-(4-chlorophenyl)-1-morpholin-4-ylheptan-3-ol;hydrochloride.
What is the SMILES notation for 3-(4-chlorophenyl)-1-morpholin-4-ylheptan-3-ol;hydrochloride?
The canonical SMILES for 3-(4-chlorophenyl)-1-morpholin-4-ylheptan-3-ol;hydrochloride is CCCCC(O)(CCN1CCOCC1)c1ccc(Cl)cc1.Cl.
What is the InChIKey of 3-(4-chlorophenyl)-1-morpholin-4-ylheptan-3-ol;hydrochloride?
The InChIKey is KKCWAVVBDYZONJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26ClNO2.ClH/c1-2-3-8-17(20,15-4-6-16(18)7-5-15)9-10-19-11-13-21-14-12-19;/h4-7,20H,2-3,8-14H2,1H3;1H.
What are the key properties of 3-(4-chlorophenyl)-1-morpholin-4-ylheptan-3-ol;hydrochloride?
3-(4-chlorophenyl)-1-morpholin-4-ylheptan-3-ol;hydrochloride has a molecular weight of 348.31 g/mol, XLogP of 3.86, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-chlorophenyl)-1-morpholin-4-ylheptan-3-ol;hydrochloride is sourced from PubChem (CID 2984506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).