N-[2-(4-ethylphenyl)-2-morpholin-4-ylethyl]butanamide

C18H28N2O2 — CID 112506556

IUPACN-[2-(4-ethylphenyl)-2-morpholin-4-ylethyl]butanamide
SMILESCCCC(=O)NCC(c1ccc(CC)cc1)N1CCOCC1
InChIInChI=1S/C18H28N2O2/c1-3-5-18(21)19-14-17(20-10-12-22-13-11-20)16-8-6-15(4-2)7-9-16/h6-9,17H,3-5,10-14H2,1-2H3,(H,19,21)
InChIKeyBZIAHFFRGRAHDY-UHFFFAOYSA-N
MW304.43 g/mol
LogP2.54
Rot. Bonds7

About N-[2-(4-ethylphenyl)-2-morpholin-4-ylethyl]butanamide

N-[2-(4-ethylphenyl)-2-morpholin-4-ylethyl]butanamide (PubChem CID 112506556) has the molecular formula C18H28N2O2 and a molecular weight of 304.43 g/mol. Its IUPAC name is N-[2-(4-ethylphenyl)-2-morpholin-4-ylethyl]butanamide.

Molecular Properties

Compound NameN-[2-(4-ethylphenyl)-2-morpholin-4-ylethyl]butanamide
PubChem CID112506556
Molecular FormulaC18H28N2O2
Molecular Weight304.43 g/mol
Exact Mass304.22
IUPAC NameN-[2-(4-ethylphenyl)-2-morpholin-4-ylethyl]butanamide
SMILESCCCC(=O)NCC(c1ccc(CC)cc1)N1CCOCC1
InChIInChI=1S/C18H28N2O2/c1-3-5-18(21)19-14-17(20-10-12-22-13-11-20)16-8-6-15(4-2)7-9-16/h6-9,17H,3-5,10-14H2,1-2H3,(H,19,21)
InChIKeyBZIAHFFRGRAHDY-UHFFFAOYSA-N
XLogP2.54
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.43
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(4-methylphenyl)-2-morpholin-4-ylethyl]butanamide;hydrochloride
CID 52984360
N-[(2S)-2-[4-(dimethylamino)phenyl]-2-morpholin-4-ylethyl]butanamide
CID 7496635
N-[2-(4-ethylphenyl)-2-morpholin-4-ylethyl]-4-(4-fluorophenyl)butanamide
CID 110304177
N-[2-(4-chlorophenyl)-2-morpholin-4-ylethyl]pentanamide
CID 60597314
2-(4-ethylphenoxy)-N-[(2S)-2-(4-methylphenyl)-2-morpholin-4-ylethyl]acetamide
CID 34949571
ethyl 2-[[2-(4-ethylphenyl)-2-morpholin-4-ylethyl]amino]-2-oxoacetate
CID 112506594
4-(4-methylphenyl)-N-[2-(4-methylphenyl)-2-morpholin-4-ylethyl]butanamide
CID 110302631
3-(4-methoxyphenyl)-N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]propanamide
CID 44892273
N-[2-(4-ethylphenyl)-2-morpholin-4-ylethyl]-2-(5-methyl-1,2,4-oxadiazol-3-yl)acetamide
CID 110623840
N-[(2S)-2-(furan-2-yl)-2-morpholin-4-ylethyl]butanamide
CID 26819488
N-[2-(4-chlorophenyl)-2-morpholin-4-ylethyl]propanamide
CID 47459894
2-(4-fluorophenyl)-N-[(2R)-2-(4-fluorophenyl)-2-morpholin-4-ylethyl]acetamide
CID 30834749

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-ethylphenyl)-2-morpholin-4-ylethyl]butanamide?
The IUPAC name of N-[2-(4-ethylphenyl)-2-morpholin-4-ylethyl]butanamide (CID 112506556) is N-[2-(4-ethylphenyl)-2-morpholin-4-ylethyl]butanamide.
What is the SMILES notation for N-[2-(4-ethylphenyl)-2-morpholin-4-ylethyl]butanamide?
The canonical SMILES for N-[2-(4-ethylphenyl)-2-morpholin-4-ylethyl]butanamide is CCCC(=O)NCC(c1ccc(CC)cc1)N1CCOCC1.
What is the InChIKey of N-[2-(4-ethylphenyl)-2-morpholin-4-ylethyl]butanamide?
The InChIKey is BZIAHFFRGRAHDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2O2/c1-3-5-18(21)19-14-17(20-10-12-22-13-11-20)16-8-6-15(4-2)7-9-16/h6-9,17H,3-5,10-14H2,1-2H3,(H,19,21).
What are the key properties of N-[2-(4-ethylphenyl)-2-morpholin-4-ylethyl]butanamide?
N-[2-(4-ethylphenyl)-2-morpholin-4-ylethyl]butanamide has a molecular weight of 304.43 g/mol, XLogP of 2.54, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-ethylphenyl)-2-morpholin-4-ylethyl]butanamide is sourced from PubChem (CID 112506556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).