(3,5-dichlorophenyl)-[3-(2-hydroxyethyl)piperidin-1-yl]methanone

C14H17Cl2NO2 — CID 62372685

IUPAC(3,5-dichlorophenyl)-[3-(2-hydroxyethyl)piperidin-1-yl]methanone
SMILESO=C(c1cc(Cl)cc(Cl)c1)N1CCCC(CCO)C1
InChIInChI=1S/C14H17Cl2NO2/c15-12-6-11(7-13(16)8-12)14(19)17-4-1-2-10(9-17)3-5-18/h6-8,10,18H,1-5,9H2
InChIKeyXTYAMIYKKWACMD-UHFFFAOYSA-N
MW302.20 g/mol
LogP3.23
Rot. Bonds3

About (3,5-dichlorophenyl)-[3-(2-hydroxyethyl)piperidin-1-yl]methanone

(3,5-dichlorophenyl)-[3-(2-hydroxyethyl)piperidin-1-yl]methanone (PubChem CID 62372685) has the molecular formula C14H17Cl2NO2 and a molecular weight of 302.20 g/mol. Its IUPAC name is (3,5-dichlorophenyl)-[3-(2-hydroxyethyl)piperidin-1-yl]methanone.

Molecular Properties

Compound Name(3,5-dichlorophenyl)-[3-(2-hydroxyethyl)piperidin-1-yl]methanone
PubChem CID62372685
Molecular FormulaC14H17Cl2NO2
Molecular Weight302.20 g/mol
Exact Mass301.06
IUPAC Name(3,5-dichlorophenyl)-[3-(2-hydroxyethyl)piperidin-1-yl]methanone
SMILESO=C(c1cc(Cl)cc(Cl)c1)N1CCCC(CCO)C1
InChIInChI=1S/C14H17Cl2NO2/c15-12-6-11(7-13(16)8-12)14(19)17-4-1-2-10(9-17)3-5-18/h6-8,10,18H,1-5,9H2
InChIKeyXTYAMIYKKWACMD-UHFFFAOYSA-N
XLogP3.23
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.20
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (3,5-dichlorophenyl)-[3-(2-hydroxyethyl)piperidin-1-yl]methanone 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

(3,5-dibromophenyl)-[3-(2-hydroxyethyl)piperidin-1-yl]methanone
CID 103909359
[3-(2-hydroxyethyl)piperidin-1-yl]-(3,4,5-trifluorophenyl)methanone
CID 63186795
(3-chloro-4-hydroxyphenyl)-[3-(2-hydroxyethyl)piperidin-1-yl]methanone
CID 62371633
(2,5-dichlorophenyl)-[3-(2-hydroxyethyl)piperidin-1-yl]methanone
CID 62371472
(3-bromo-5-chlorophenyl)-[3-(hydroxymethyl)piperidin-1-yl]methanone
CID 110633275
(4-chloro-3-methylphenyl)-[3-(2-hydroxyethyl)piperidin-1-yl]methanone
CID 112706030
(2,4-dichlorophenyl)-[3-(2-hydroxyethyl)piperidin-1-yl]methanone
CID 55209548
(5-chloro-2-fluorophenyl)-[3-(2-hydroxyethyl)piperidin-1-yl]methanone
CID 62372699
(3-chlorophenyl)-[3-(2-hydroxyethyl)pyrrolidin-1-yl]methanone
CID 115746304
[3-(2-chloroethyl)pyrrolidin-1-yl]-(3,5-dichlorophenyl)methanone
CID 114801176
[3-(2-hydroxyethyl)piperidin-1-yl]-pyrimidin-5-ylmethanone
CID 113434939
(2-amino-5-chlorophenyl)-[3-(2-hydroxyethyl)piperidin-1-yl]methanone
CID 107209681

Frequently Asked Questions

What is the IUPAC name of (3,5-dichlorophenyl)-[3-(2-hydroxyethyl)piperidin-1-yl]methanone?
The IUPAC name of (3,5-dichlorophenyl)-[3-(2-hydroxyethyl)piperidin-1-yl]methanone (CID 62372685) is (3,5-dichlorophenyl)-[3-(2-hydroxyethyl)piperidin-1-yl]methanone.
What is the SMILES notation for (3,5-dichlorophenyl)-[3-(2-hydroxyethyl)piperidin-1-yl]methanone?
The canonical SMILES for (3,5-dichlorophenyl)-[3-(2-hydroxyethyl)piperidin-1-yl]methanone is O=C(c1cc(Cl)cc(Cl)c1)N1CCCC(CCO)C1.
What is the InChIKey of (3,5-dichlorophenyl)-[3-(2-hydroxyethyl)piperidin-1-yl]methanone?
The InChIKey is XTYAMIYKKWACMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17Cl2NO2/c15-12-6-11(7-13(16)8-12)14(19)17-4-1-2-10(9-17)3-5-18/h6-8,10,18H,1-5,9H2.
What are the key properties of (3,5-dichlorophenyl)-[3-(2-hydroxyethyl)piperidin-1-yl]methanone?
(3,5-dichlorophenyl)-[3-(2-hydroxyethyl)piperidin-1-yl]methanone has a molecular weight of 302.20 g/mol, XLogP of 3.23, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3,5-dichlorophenyl)-[3-(2-hydroxyethyl)piperidin-1-yl]methanone is sourced from PubChem (CID 62372685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).