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

C17H25ClN2O2 — CID 60597314

IUPACN-[2-(4-chlorophenyl)-2-morpholin-4-ylethyl]pentanamide
SMILESCCCCC(=O)NCC(c1ccc(Cl)cc1)N1CCOCC1
InChIInChI=1S/C17H25ClN2O2/c1-2-3-4-17(21)19-13-16(20-9-11-22-12-10-20)14-5-7-15(18)8-6-14/h5-8,16H,2-4,9-13H2,1H3,(H,19,21)
InChIKeyKOTVWBHJDISNAE-UHFFFAOYSA-N
MW324.85 g/mol
LogP3.02
Rot. Bonds7

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

N-[2-(4-chlorophenyl)-2-morpholin-4-ylethyl]pentanamide (PubChem CID 60597314) has the molecular formula C17H25ClN2O2 and a molecular weight of 324.85 g/mol. Its IUPAC name is N-[2-(4-chlorophenyl)-2-morpholin-4-ylethyl]pentanamide.

Molecular Properties

Compound NameN-[2-(4-chlorophenyl)-2-morpholin-4-ylethyl]pentanamide
PubChem CID60597314
Molecular FormulaC17H25ClN2O2
Molecular Weight324.85 g/mol
Exact Mass324.16
IUPAC NameN-[2-(4-chlorophenyl)-2-morpholin-4-ylethyl]pentanamide
SMILESCCCCC(=O)NCC(c1ccc(Cl)cc1)N1CCOCC1
InChIInChI=1S/C17H25ClN2O2/c1-2-3-4-17(21)19-13-16(20-9-11-22-12-10-20)14-5-7-15(18)8-6-14/h5-8,16H,2-4,9-13H2,1H3,(H,19,21)
InChIKeyKOTVWBHJDISNAE-UHFFFAOYSA-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

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Related Compounds

N-[2-(4-chlorophenyl)-2-morpholin-4-ylethyl]propanamide
CID 47459894
N-[(2S)-2-(2-chlorophenyl)-2-morpholin-4-ylethyl]pentanamide
CID 35041740
N-[2-(1,3-benzodioxol-5-yl)-2-morpholin-4-ylethyl]pentanamide
CID 110287527
N-[2-(4-methylphenyl)-2-morpholin-4-ylethyl]butanamide;hydrochloride
CID 52984360
N-[2-(4-ethylphenyl)-2-morpholin-4-ylethyl]butanamide
CID 112506556
1-[2-(4-chlorophenyl)-2-morpholin-4-ylethyl]-3-(2-methylpropyl)urea
CID 110621889
N-[(2S)-2-(4-chlorophenyl)-2-pyrrolidin-1-ylethyl]-3-morpholin-4-ylpropanamide
CID 125157433
N-[(2R)-2-(4-chlorophenyl)-2-(4-methylpiperazin-1-yl)ethyl]butanamide
CID 35180484
N-[2-(4-chlorophenyl)-2-morpholin-4-ylethyl]-3-(2-fluorophenyl)sulfanylpropanamide
CID 60597341
N-[(2S)-2-[4-(dimethylamino)phenyl]-2-morpholin-4-ylethyl]butanamide
CID 7496635
N-[(2S)-2-(4-chlorophenyl)-2-morpholin-4-ylethyl]-4-(cyclohexylcarbamoylamino)butanamide
CID 52506860
1-butyl-3-[2-(4-chlorophenyl)-2-morpholin-4-ylethyl]-2-methylguanidine
CID 111151950

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-chlorophenyl)-2-morpholin-4-ylethyl]pentanamide?
The IUPAC name of N-[2-(4-chlorophenyl)-2-morpholin-4-ylethyl]pentanamide (CID 60597314) is N-[2-(4-chlorophenyl)-2-morpholin-4-ylethyl]pentanamide.
What is the SMILES notation for N-[2-(4-chlorophenyl)-2-morpholin-4-ylethyl]pentanamide?
The canonical SMILES for N-[2-(4-chlorophenyl)-2-morpholin-4-ylethyl]pentanamide is CCCCC(=O)NCC(c1ccc(Cl)cc1)N1CCOCC1.
What is the InChIKey of N-[2-(4-chlorophenyl)-2-morpholin-4-ylethyl]pentanamide?
The InChIKey is KOTVWBHJDISNAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25ClN2O2/c1-2-3-4-17(21)19-13-16(20-9-11-22-12-10-20)14-5-7-15(18)8-6-14/h5-8,16H,2-4,9-13H2,1H3,(H,19,21).
What are the key properties of N-[2-(4-chlorophenyl)-2-morpholin-4-ylethyl]pentanamide?
N-[2-(4-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-[2-(4-chlorophenyl)-2-morpholin-4-ylethyl]pentanamide is sourced from PubChem (CID 60597314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).