4-(2-chlorophenyl)-N-(2-methylpiperidin-3-yl)oxane-4-carboxamide;hydrochloride

C18H26Cl2N2O2 — CID 120576460

IUPAC4-(2-chlorophenyl)-N-(2-methylpiperidin-3-yl)oxane-4-carboxamide;hydrochloride
SMILESCC1NCCCC1NC(=O)C1(c2ccccc2Cl)CCOCC1.Cl
InChIInChI=1S/C18H25ClN2O2.ClH/c1-13-16(7-4-10-20-13)21-17(22)18(8-11-23-12-9-18)14-5-2-3-6-15(14)19;/h2-3,5-6,13,16,20H,4,7-12H2,1H3,(H,21,22);1H
InChIKeyOFRZMEBYLSARCL-UHFFFAOYSA-N
MW373.32 g/mol
LogP3.07
Rot. Bonds3

About 4-(2-chlorophenyl)-N-(2-methylpiperidin-3-yl)oxane-4-carboxamide;hydrochloride

4-(2-chlorophenyl)-N-(2-methylpiperidin-3-yl)oxane-4-carboxamide;hydrochloride (PubChem CID 120576460) has the molecular formula C18H26Cl2N2O2 and a molecular weight of 373.32 g/mol. Its IUPAC name is 4-(2-chlorophenyl)-N-(2-methylpiperidin-3-yl)oxane-4-carboxamide;hydrochloride.

Molecular Properties

Compound Name4-(2-chlorophenyl)-N-(2-methylpiperidin-3-yl)oxane-4-carboxamide;hydrochloride
PubChem CID120576460
Molecular FormulaC18H26Cl2N2O2
Molecular Weight373.32 g/mol
Exact Mass372.14
IUPAC Name4-(2-chlorophenyl)-N-(2-methylpiperidin-3-yl)oxane-4-carboxamide;hydrochloride
SMILESCC1NCCCC1NC(=O)C1(c2ccccc2Cl)CCOCC1.Cl
InChIInChI=1S/C18H25ClN2O2.ClH/c1-13-16(7-4-10-20-13)21-17(22)18(8-11-23-12-9-18)14-5-2-3-6-15(14)19;/h2-3,5-6,13,16,20H,4,7-12H2,1H3,(H,21,22);1H
InChIKeyOFRZMEBYLSARCL-UHFFFAOYSA-N
XLogP3.07
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.32
LogP ≤ 53.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-(2-chlorophenyl)-N-(2-methylpiperidin-3-yl)oxane-4-carboxamide;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

4-(2-chlorophenyl)-N-(2-methylpiperidin-3-yl)oxane-4-carboxamide
CID 120576461
4-(3-chlorophenyl)-N-(2-methylpiperidin-3-yl)oxane-4-carboxamide
CID 120573485
N-(2-methylpiperidin-3-yl)-1-phenylcyclopentane-1-carboxamide;hydrochloride
CID 120577312
4-(2-chlorophenyl)-N-piperidin-3-yloxane-4-carboxamide
CID 119427380
1-(4-chlorophenyl)-N-(2-methylpiperidin-3-yl)cyclopentane-1-carboxamide
CID 120573779
4-(2-chlorophenyl)-N-(piperidin-3-ylmethyl)oxane-4-carboxamide
CID 119462852
1-(4-fluorophenyl)-N-(2-methylpiperidin-3-yl)cyclopropane-1-carboxamide;hydrochloride
CID 120575377
N-(2-amino-1-cyclopropylethyl)-4-(2-chlorophenyl)oxane-4-carboxamide
CID 119615938
2-(2-chlorophenoxy)-N-(2-methylpiperidin-3-yl)acetamide;hydrochloride
CID 120575020
3-chloro-2-methyl-N-(2-methylpiperidin-3-yl)benzamide
CID 107098369
(2S)-2-[[4-(2-chlorophenyl)oxane-4-carbonyl]amino]propanoic acid
CID 119238677
4-(2-chlorophenyl)-N-[(2S)-oxan-2-yl]oxyoxane-4-carboxamide
CID 95322508

Frequently Asked Questions

What is the IUPAC name of 4-(2-chlorophenyl)-N-(2-methylpiperidin-3-yl)oxane-4-carboxamide;hydrochloride?
The IUPAC name of 4-(2-chlorophenyl)-N-(2-methylpiperidin-3-yl)oxane-4-carboxamide;hydrochloride (CID 120576460) is 4-(2-chlorophenyl)-N-(2-methylpiperidin-3-yl)oxane-4-carboxamide;hydrochloride.
What is the SMILES notation for 4-(2-chlorophenyl)-N-(2-methylpiperidin-3-yl)oxane-4-carboxamide;hydrochloride?
The canonical SMILES for 4-(2-chlorophenyl)-N-(2-methylpiperidin-3-yl)oxane-4-carboxamide;hydrochloride is CC1NCCCC1NC(=O)C1(c2ccccc2Cl)CCOCC1.Cl.
What is the InChIKey of 4-(2-chlorophenyl)-N-(2-methylpiperidin-3-yl)oxane-4-carboxamide;hydrochloride?
The InChIKey is OFRZMEBYLSARCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25ClN2O2.ClH/c1-13-16(7-4-10-20-13)21-17(22)18(8-11-23-12-9-18)14-5-2-3-6-15(14)19;/h2-3,5-6,13,16,20H,4,7-12H2,1H3,(H,21,22);1H.
What are the key properties of 4-(2-chlorophenyl)-N-(2-methylpiperidin-3-yl)oxane-4-carboxamide;hydrochloride?
4-(2-chlorophenyl)-N-(2-methylpiperidin-3-yl)oxane-4-carboxamide;hydrochloride has a molecular weight of 373.32 g/mol, XLogP of 3.07, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-chlorophenyl)-N-(2-methylpiperidin-3-yl)oxane-4-carboxamide;hydrochloride is sourced from PubChem (CID 120576460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).