1-[(4-chlorophenyl)methyl]-N-[[(2R)-oxolan-2-yl]methyl]piperidine-4-carboxamide

C18H25ClN2O2 — CID 807207

IUPAC1-[(4-chlorophenyl)methyl]-N-[[(2R)-oxolan-2-yl]methyl]piperidine-4-carboxamide
SMILESO=C(NC[C@H]1CCCO1)C1CCN(Cc2ccc(Cl)cc2)CC1
InChIInChI=1S/C18H25ClN2O2/c19-16-5-3-14(4-6-16)13-21-9-7-15(8-10-21)18(22)20-12-17-2-1-11-23-17/h3-6,15,17H,1-2,7-13H2,(H,20,22)/t17-/m1/s1
InChIKeyFAZMFTKCIPTXLK-QGZVFWFLSA-N
MW336.86 g/mol
LogP2.85
Rot. Bonds5

About 1-[(4-chlorophenyl)methyl]-N-[[(2R)-oxolan-2-yl]methyl]piperidine-4-carboxamide

1-[(4-chlorophenyl)methyl]-N-[[(2R)-oxolan-2-yl]methyl]piperidine-4-carboxamide (PubChem CID 807207) has the molecular formula C18H25ClN2O2 and a molecular weight of 336.86 g/mol. Its IUPAC name is 1-[(4-chlorophenyl)methyl]-N-[[(2R)-oxolan-2-yl]methyl]piperidine-4-carboxamide.

Molecular Properties

Compound Name1-[(4-chlorophenyl)methyl]-N-[[(2R)-oxolan-2-yl]methyl]piperidine-4-carboxamide
PubChem CID807207
Molecular FormulaC18H25ClN2O2
Molecular Weight336.86 g/mol
Exact Mass336.16
IUPAC Name1-[(4-chlorophenyl)methyl]-N-[[(2R)-oxolan-2-yl]methyl]piperidine-4-carboxamide
SMILESO=C(NC[C@H]1CCCO1)C1CCN(Cc2ccc(Cl)cc2)CC1
InChIInChI=1S/C18H25ClN2O2/c19-16-5-3-14(4-6-16)13-21-9-7-15(8-10-21)18(22)20-12-17-2-1-11-23-17/h3-6,15,17H,1-2,7-13H2,(H,20,22)/t17-/m1/s1
InChIKeyFAZMFTKCIPTXLK-QGZVFWFLSA-N
XLogP2.85
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.86
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-[(4-chlorophenyl)methyl]-N-[[(2R)-oxolan-2-yl]methyl]piperidine-4-carboxamide 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

N-[2-(4-chlorophenyl)ethyl]oxolane-2-carboxamide
CID 2970803
N-(4-chlorobenzyl)tetrahydro-2-furancarboxamide
CID 2932408
N-[(2-chlorophenyl)methyl]oxolane-2-carboxamide
CID 2957283
N-[(3-chlorophenyl)methyl]oxolane-2-carboxamide
CID 2971265
N-[(4-chlorophenyl)methyl]-2-(2,6-dimethylmorpholin-4-yl)acetamide
CID 6465678
(4-Chloro-benzyl)-(tetrahydro-furan-2-ylmethyl)-amine hydrobromide
CID 24746853
N1-(2,4-dichlorobenzyl)-N4-(2-(tetrahydro-2H-pyran-4-yl)ethyl)piperidine-1,4-dicarboxamide
CID 24748515
N1-(2,4-dichlorobenzyl)-N4-(2-methoxyethyl)piperidine-1,4-dicarboxamide
CID 24748561
1-(4-chlorobenzoyl)-N-(tetrahydro-2-furanylmethyl)-4-piperidinecarboxamide
CID 2921033
1-(2-chlorobenzyl)-5-oxo-N-(tetrahydrofuran-2-ylmethyl)prolinamide
CID 3245714
1-[bis(4-chlorophenyl)methyl]-N-(2-methoxyethyl)piperidine-4-carboxamide
CID 44528938
N-(4-chlorobenzyl)-N'-[3-(4-morpholinyl)propyl]ethanediamide
CID 2172999

Frequently Asked Questions

What is the IUPAC name of 1-[(4-chlorophenyl)methyl]-N-[[(2R)-oxolan-2-yl]methyl]piperidine-4-carboxamide?
The IUPAC name of 1-[(4-chlorophenyl)methyl]-N-[[(2R)-oxolan-2-yl]methyl]piperidine-4-carboxamide (CID 807207) is 1-[(4-chlorophenyl)methyl]-N-[[(2R)-oxolan-2-yl]methyl]piperidine-4-carboxamide.
What is the SMILES notation for 1-[(4-chlorophenyl)methyl]-N-[[(2R)-oxolan-2-yl]methyl]piperidine-4-carboxamide?
The canonical SMILES for 1-[(4-chlorophenyl)methyl]-N-[[(2R)-oxolan-2-yl]methyl]piperidine-4-carboxamide is O=C(NC[C@H]1CCCO1)C1CCN(Cc2ccc(Cl)cc2)CC1.
What is the InChIKey of 1-[(4-chlorophenyl)methyl]-N-[[(2R)-oxolan-2-yl]methyl]piperidine-4-carboxamide?
The InChIKey is FAZMFTKCIPTXLK-QGZVFWFLSA-N. The full InChI is InChI=1S/C18H25ClN2O2/c19-16-5-3-14(4-6-16)13-21-9-7-15(8-10-21)18(22)20-12-17-2-1-11-23-17/h3-6,15,17H,1-2,7-13H2,(H,20,22)/t17-/m1/s1.
What are the key properties of 1-[(4-chlorophenyl)methyl]-N-[[(2R)-oxolan-2-yl]methyl]piperidine-4-carboxamide?
1-[(4-chlorophenyl)methyl]-N-[[(2R)-oxolan-2-yl]methyl]piperidine-4-carboxamide has a molecular weight of 336.86 g/mol, XLogP of 2.85, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4-chlorophenyl)methyl]-N-[[(2R)-oxolan-2-yl]methyl]piperidine-4-carboxamide is sourced from PubChem (CID 807207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).