5-amino-N-ethyl-2-(4-fluorophenyl)pentanamide

C13H19FN2O — CID 112515678

IUPAC5-amino-N-ethyl-2-(4-fluorophenyl)pentanamide
SMILESCCNC(=O)C(CCCN)c1ccc(F)cc1
InChIInChI=1S/C13H19FN2O/c1-2-16-13(17)12(4-3-9-15)10-5-7-11(14)8-6-10/h5-8,12H,2-4,9,15H2,1H3,(H,16,17)
InChIKeyOHGNGNKMZRCGNP-UHFFFAOYSA-N
MW238.31 g/mol
LogP1.78
Rot. Bonds6

About 5-amino-N-ethyl-2-(4-fluorophenyl)pentanamide

5-amino-N-ethyl-2-(4-fluorophenyl)pentanamide (PubChem CID 112515678) has the molecular formula C13H19FN2O and a molecular weight of 238.31 g/mol. Its IUPAC name is 5-amino-N-ethyl-2-(4-fluorophenyl)pentanamide.

Molecular Properties

Compound Name5-amino-N-ethyl-2-(4-fluorophenyl)pentanamide
PubChem CID112515678
Molecular FormulaC13H19FN2O
Molecular Weight238.31 g/mol
Exact Mass238.15
IUPAC Name5-amino-N-ethyl-2-(4-fluorophenyl)pentanamide
SMILESCCNC(=O)C(CCCN)c1ccc(F)cc1
InChIInChI=1S/C13H19FN2O/c1-2-16-13(17)12(4-3-9-15)10-5-7-11(14)8-6-10/h5-8,12H,2-4,9,15H2,1H3,(H,16,17)
InChIKeyOHGNGNKMZRCGNP-UHFFFAOYSA-N
XLogP1.78
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.31
LogP ≤ 51.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-amino-N-ethyl-2-(4-fluorophenyl)propanamide;hydrochloride
CID 120616335
5-(ethylamino)-4-(4-fluorophenyl)-5-oxopentanoic acid
CID 112516346
4-amino-2-(4-fluorophenyl)-N-(2-methylpropyl)butanamide
CID 112516304
5-amino-N-ethyl-N-[1-(4-fluorophenyl)ethyl]-2-methylpentanamide
CID 104684492
5-amino-N-methyl-2-(4-propan-2-ylphenyl)pentanamide
CID 112516027
4-[2-(4-fluorophenyl)butanoylamino]butanoic acid
CID 120513410
5-amino-N-[1-(4-fluorophenyl)-2,2-dimethylpropyl]-2-methylpentanamide
CID 104684157
(2R)-N-ethyl-3-(4-fluorophenyl)-2-methylpropanamide
CID 143947459
2-(4-fluorophenyl)heptanoic acid
CID 79435490
5-amino-N-ethyl-2-methylpentanamide
CID 134525204
2-(4-fluorophenyl)nonanoic acid
CID 79434490
methyl 2-(4-fluorophenyl)-3-sulfanylpropanoate
CID 117245362

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-ethyl-2-(4-fluorophenyl)pentanamide?
The IUPAC name of 5-amino-N-ethyl-2-(4-fluorophenyl)pentanamide (CID 112515678) is 5-amino-N-ethyl-2-(4-fluorophenyl)pentanamide.
What is the SMILES notation for 5-amino-N-ethyl-2-(4-fluorophenyl)pentanamide?
The canonical SMILES for 5-amino-N-ethyl-2-(4-fluorophenyl)pentanamide is CCNC(=O)C(CCCN)c1ccc(F)cc1.
What is the InChIKey of 5-amino-N-ethyl-2-(4-fluorophenyl)pentanamide?
The InChIKey is OHGNGNKMZRCGNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19FN2O/c1-2-16-13(17)12(4-3-9-15)10-5-7-11(14)8-6-10/h5-8,12H,2-4,9,15H2,1H3,(H,16,17).
What are the key properties of 5-amino-N-ethyl-2-(4-fluorophenyl)pentanamide?
5-amino-N-ethyl-2-(4-fluorophenyl)pentanamide has a molecular weight of 238.31 g/mol, XLogP of 1.78, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-ethyl-2-(4-fluorophenyl)pentanamide is sourced from PubChem (CID 112515678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).