3-(2,4-dichlorophenoxy)-N-[[(2R)-6-oxopiperidin-2-yl]methyl]propanamide

C15H18Cl2N2O3 — CID 167928916

IUPAC3-(2,4-dichlorophenoxy)-N-[[(2R)-6-oxopiperidin-2-yl]methyl]propanamide
SMILESO=C(CCOc1ccc(Cl)cc1Cl)NC[C@H]1CCCC(=O)N1
InChIInChI=1S/C15H18Cl2N2O3/c16-10-4-5-13(12(17)8-10)22-7-6-14(20)18-9-11-2-1-3-15(21)19-11/h4-5,8,11H,1-3,6-7,9H2,(H,18,20)(H,19,21)/t11-/m1/s1
InChIKeyTVGLXHOJFPZGOT-LLVKDONJSA-N
MW345.23 g/mol
LogP2.55
Rot. Bonds6

About 3-(2,4-dichlorophenoxy)-N-[[(2R)-6-oxopiperidin-2-yl]methyl]propanamide

3-(2,4-dichlorophenoxy)-N-[[(2R)-6-oxopiperidin-2-yl]methyl]propanamide (PubChem CID 167928916) has the molecular formula C15H18Cl2N2O3 and a molecular weight of 345.23 g/mol. Its IUPAC name is 3-(2,4-dichlorophenoxy)-N-[[(2R)-6-oxopiperidin-2-yl]methyl]propanamide.

Molecular Properties

Compound Name3-(2,4-dichlorophenoxy)-N-[[(2R)-6-oxopiperidin-2-yl]methyl]propanamide
PubChem CID167928916
Molecular FormulaC15H18Cl2N2O3
Molecular Weight345.23 g/mol
Exact Mass344.07
IUPAC Name3-(2,4-dichlorophenoxy)-N-[[(2R)-6-oxopiperidin-2-yl]methyl]propanamide
SMILESO=C(CCOc1ccc(Cl)cc1Cl)NC[C@H]1CCCC(=O)N1
InChIInChI=1S/C15H18Cl2N2O3/c16-10-4-5-13(12(17)8-10)22-7-6-14(20)18-9-11-2-1-3-15(21)19-11/h4-5,8,11H,1-3,6-7,9H2,(H,18,20)(H,19,21)/t11-/m1/s1
InChIKeyTVGLXHOJFPZGOT-LLVKDONJSA-N
XLogP2.55
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.23
LogP ≤ 52.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3-(2,4-dichlorophenoxy)-N-[[(2R)-6-oxopiperidin-2-yl]methyl]propanamide 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

5-chloro-N-[[(2S)-5-oxopyrrolidin-2-yl]methyl]-2-propoxybenzamide
CID 97221382
(2S)-N-[3-(2,4-dichlorophenoxy)propyl]-5-oxopyrrolidine-2-carboxamide
CID 95040802
4-(2,4-dichlorophenoxy)-N-[4-[4-(2,4-dichlorophenoxy)butanoylamino]butyl]butanamide
CID 2841733
2,6-dichloro-N-[[(2R)-6-oxopiperidin-2-yl]methyl]benzamide
CID 154844464
4-(2-chlorophenoxy)-N-(pyrrolidin-2-ylmethyl)butanamide;hydrochloride
CID 119514717
4-[2-(2,4-dichlorophenoxy)ethylamino]-4-oxobutanoic acid
CID 9156378
4-(2,4-dichlorophenoxy)-N-(3-methoxypropyl)butanamide
CID 2227549
3-(2,4-dichlorophenoxy)-N-(4-hydroxy-2-methylpentyl)propanamide
CID 111447156
N-[1-(aminomethyl)cyclopentyl]-3-(2,4-dichlorophenoxy)propanamide;hydrochloride
CID 119567423
N-(3-aminobutyl)-3-(2,4-dichlorophenoxy)propanamide;hydrochloride
CID 119498285
2-(cyclopropylmethylamino)-N-[3-(2,4-dichlorophenoxy)propyl]acetamide;hydrochloride
CID 119754502
3-(2,4-dichlorophenoxy)-1-[4-(ethylaminomethyl)piperidin-1-yl]propan-1-one
CID 119647198

Frequently Asked Questions

What is the IUPAC name of 3-(2,4-dichlorophenoxy)-N-[[(2R)-6-oxopiperidin-2-yl]methyl]propanamide?
The IUPAC name of 3-(2,4-dichlorophenoxy)-N-[[(2R)-6-oxopiperidin-2-yl]methyl]propanamide (CID 167928916) is 3-(2,4-dichlorophenoxy)-N-[[(2R)-6-oxopiperidin-2-yl]methyl]propanamide.
What is the SMILES notation for 3-(2,4-dichlorophenoxy)-N-[[(2R)-6-oxopiperidin-2-yl]methyl]propanamide?
The canonical SMILES for 3-(2,4-dichlorophenoxy)-N-[[(2R)-6-oxopiperidin-2-yl]methyl]propanamide is O=C(CCOc1ccc(Cl)cc1Cl)NC[C@H]1CCCC(=O)N1.
What is the InChIKey of 3-(2,4-dichlorophenoxy)-N-[[(2R)-6-oxopiperidin-2-yl]methyl]propanamide?
The InChIKey is TVGLXHOJFPZGOT-LLVKDONJSA-N. The full InChI is InChI=1S/C15H18Cl2N2O3/c16-10-4-5-13(12(17)8-10)22-7-6-14(20)18-9-11-2-1-3-15(21)19-11/h4-5,8,11H,1-3,6-7,9H2,(H,18,20)(H,19,21)/t11-/m1/s1.
What are the key properties of 3-(2,4-dichlorophenoxy)-N-[[(2R)-6-oxopiperidin-2-yl]methyl]propanamide?
3-(2,4-dichlorophenoxy)-N-[[(2R)-6-oxopiperidin-2-yl]methyl]propanamide has a molecular weight of 345.23 g/mol, XLogP of 2.55, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,4-dichlorophenoxy)-N-[[(2R)-6-oxopiperidin-2-yl]methyl]propanamide is sourced from PubChem (CID 167928916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).