N-[(2S)-2-(2-chlorophenyl)-2-morpholin-4-ylethyl]pentanamide

C17H25ClN2O2 — CID 35041740

IUPACN-[(2S)-2-(2-chlorophenyl)-2-morpholin-4-ylethyl]pentanamide
SMILESCCCCC(=O)NC[C@H](c1ccccc1Cl)N1CCOCC1
InChIInChI=1S/C17H25ClN2O2/c1-2-3-8-17(21)19-13-16(20-9-11-22-12-10-20)14-6-4-5-7-15(14)18/h4-7,16H,2-3,8-13H2,1H3,(H,19,21)/t16-/m1/s1
InChIKeyRTSUAUHZPJUDOS-MRXNPFEDSA-N
MW324.85 g/mol
LogP3.02
Rot. Bonds7

About N-[(2S)-2-(2-chlorophenyl)-2-morpholin-4-ylethyl]pentanamide

N-[(2S)-2-(2-chlorophenyl)-2-morpholin-4-ylethyl]pentanamide (PubChem CID 35041740) has the molecular formula C17H25ClN2O2 and a molecular weight of 324.85 g/mol. Its IUPAC name is N-[(2S)-2-(2-chlorophenyl)-2-morpholin-4-ylethyl]pentanamide.

Molecular Properties

Compound NameN-[(2S)-2-(2-chlorophenyl)-2-morpholin-4-ylethyl]pentanamide
PubChem CID35041740
Molecular FormulaC17H25ClN2O2
Molecular Weight324.85 g/mol
Exact Mass324.16
IUPAC NameN-[(2S)-2-(2-chlorophenyl)-2-morpholin-4-ylethyl]pentanamide
SMILESCCCCC(=O)NC[C@H](c1ccccc1Cl)N1CCOCC1
InChIInChI=1S/C17H25ClN2O2/c1-2-3-8-17(21)19-13-16(20-9-11-22-12-10-20)14-6-4-5-7-15(14)18/h4-7,16H,2-3,8-13H2,1H3,(H,19,21)/t16-/m1/s1
InChIKeyRTSUAUHZPJUDOS-MRXNPFEDSA-N
XLogP3.02
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.85
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[(2S)-2-(2-chlorophenyl)-2-morpholin-4-ylethyl]pentanamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[(2S)-2-(2-chlorophenyl)-2-morpholin-4-ylethyl]pentanamide?
The IUPAC name of N-[(2S)-2-(2-chlorophenyl)-2-morpholin-4-ylethyl]pentanamide (CID 35041740) is N-[(2S)-2-(2-chlorophenyl)-2-morpholin-4-ylethyl]pentanamide.
What is the SMILES notation for N-[(2S)-2-(2-chlorophenyl)-2-morpholin-4-ylethyl]pentanamide?
The canonical SMILES for N-[(2S)-2-(2-chlorophenyl)-2-morpholin-4-ylethyl]pentanamide is CCCCC(=O)NC[C@H](c1ccccc1Cl)N1CCOCC1.
What is the InChIKey of N-[(2S)-2-(2-chlorophenyl)-2-morpholin-4-ylethyl]pentanamide?
The InChIKey is RTSUAUHZPJUDOS-MRXNPFEDSA-N. The full InChI is InChI=1S/C17H25ClN2O2/c1-2-3-8-17(21)19-13-16(20-9-11-22-12-10-20)14-6-4-5-7-15(14)18/h4-7,16H,2-3,8-13H2,1H3,(H,19,21)/t16-/m1/s1.
What are the key properties of N-[(2S)-2-(2-chlorophenyl)-2-morpholin-4-ylethyl]pentanamide?
N-[(2S)-2-(2-chlorophenyl)-2-morpholin-4-ylethyl]pentanamide has a molecular weight of 324.85 g/mol, XLogP of 3.02, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2S)-2-(2-chlorophenyl)-2-morpholin-4-ylethyl]pentanamide is sourced from PubChem (CID 35041740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).