N-ethyl-N-[1-(4-fluorophenyl)ethyl]-4-methylpentanamide

C16H24FNO — CID 78892655

IUPACN-ethyl-N-[1-(4-fluorophenyl)ethyl]-4-methylpentanamide
SMILESCCN(C(=O)CCC(C)C)C(C)c1ccc(F)cc1
InChIInChI=1S/C16H24FNO/c1-5-18(16(19)11-6-12(2)3)13(4)14-7-9-15(17)10-8-14/h7-10,12-13H,5-6,11H2,1-4H3
InChIKeyJQTSDWFYOZCTOC-UHFFFAOYSA-N
MW265.37 g/mol
LogP4.17
Rot. Bonds6

About N-ethyl-N-[1-(4-fluorophenyl)ethyl]-4-methylpentanamide

N-ethyl-N-[1-(4-fluorophenyl)ethyl]-4-methylpentanamide (PubChem CID 78892655) has the molecular formula C16H24FNO and a molecular weight of 265.37 g/mol. Its IUPAC name is N-ethyl-N-[1-(4-fluorophenyl)ethyl]-4-methylpentanamide.

Molecular Properties

Compound NameN-ethyl-N-[1-(4-fluorophenyl)ethyl]-4-methylpentanamide
PubChem CID78892655
Molecular FormulaC16H24FNO
Molecular Weight265.37 g/mol
Exact Mass265.18
IUPAC NameN-ethyl-N-[1-(4-fluorophenyl)ethyl]-4-methylpentanamide
SMILESCCN(C(=O)CCC(C)C)C(C)c1ccc(F)cc1
InChIInChI=1S/C16H24FNO/c1-5-18(16(19)11-6-12(2)3)13(4)14-7-9-15(17)10-8-14/h7-10,12-13H,5-6,11H2,1-4H3
InChIKeyJQTSDWFYOZCTOC-UHFFFAOYSA-N
XLogP4.17
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.37
LogP ≤ 54.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

3-chloro-N-ethyl-N-[1-(4-fluorophenyl)ethyl]propanamide
CID 54875564
5-amino-N-ethyl-N-[1-(4-fluorophenyl)ethyl]hexanamide
CID 82852194
ethyl 4-[ethyl-[1-(4-fluorophenyl)ethyl]amino]-4-oxobutanoate
CID 60795014
N-ethyl-N-[1-(4-fluorophenyl)ethyl]-3-oxobutanamide
CID 54876478
N-ethyl-N-[1-(4-fluorophenyl)ethyl]acetamide
CID 60794877
N-ethyl-N-[1-(4-fluorophenyl)ethyl]-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 115950073
N-ethyl-N-[1-(4-fluorophenyl)ethyl]-2-(4-fluorophenyl)sulfonylpropanamide
CID 86850077
2-(4-aminophenyl)-N-ethyl-N-[1-(4-fluorophenyl)ethyl]acetamide;hydrochloride
CID 119737208
3-amino-N-ethyl-N-[1-(4-fluorophenyl)ethyl]-3-phenylpropanamide
CID 119950245
N-ethyl-N-[1-(4-fluorophenyl)ethyl]-2-(prop-2-ynylamino)acetamide
CID 79287578
N-ethyl-N-[(1R)-1-(4-fluorophenyl)ethyl]-4-(1,2,4-triazol-1-yl)butanamide
CID 96533403
N-ethyl-N-[1-(4-fluorophenyl)ethyl]-2-piperidin-4-ylacetamide
CID 61029614

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-[1-(4-fluorophenyl)ethyl]-4-methylpentanamide?
The IUPAC name of N-ethyl-N-[1-(4-fluorophenyl)ethyl]-4-methylpentanamide (CID 78892655) is N-ethyl-N-[1-(4-fluorophenyl)ethyl]-4-methylpentanamide.
What is the SMILES notation for N-ethyl-N-[1-(4-fluorophenyl)ethyl]-4-methylpentanamide?
The canonical SMILES for N-ethyl-N-[1-(4-fluorophenyl)ethyl]-4-methylpentanamide is CCN(C(=O)CCC(C)C)C(C)c1ccc(F)cc1.
What is the InChIKey of N-ethyl-N-[1-(4-fluorophenyl)ethyl]-4-methylpentanamide?
The InChIKey is JQTSDWFYOZCTOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24FNO/c1-5-18(16(19)11-6-12(2)3)13(4)14-7-9-15(17)10-8-14/h7-10,12-13H,5-6,11H2,1-4H3.
What are the key properties of N-ethyl-N-[1-(4-fluorophenyl)ethyl]-4-methylpentanamide?
N-ethyl-N-[1-(4-fluorophenyl)ethyl]-4-methylpentanamide has a molecular weight of 265.37 g/mol, XLogP of 4.17, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-[1-(4-fluorophenyl)ethyl]-4-methylpentanamide is sourced from PubChem (CID 78892655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).