2-amino-N-[(1R)-1-(4-fluorophenyl)ethyl]-5-methoxypentanamide

C14H21FN2O2 — CID 81349504

IUPAC2-amino-N-[(1R)-1-(4-fluorophenyl)ethyl]-5-methoxypentanamide
SMILESCOCCCC(N)C(=O)N[C@H](C)c1ccc(F)cc1
InChIInChI=1S/C14H21FN2O2/c1-10(11-5-7-12(15)8-6-11)17-14(18)13(16)4-3-9-19-2/h5-8,10,13H,3-4,9,16H2,1-2H3,(H,17,18)/t10-,13?/m1/s1
InChIKeyWHDAIUWHPZTRFY-VUUHIHSGSA-N
MW268.33 g/mol
LogP1.76
Rot. Bonds7

About 2-amino-N-[(1R)-1-(4-fluorophenyl)ethyl]-5-methoxypentanamide

2-amino-N-[(1R)-1-(4-fluorophenyl)ethyl]-5-methoxypentanamide (PubChem CID 81349504) has the molecular formula C14H21FN2O2 and a molecular weight of 268.33 g/mol. Its IUPAC name is 2-amino-N-[(1R)-1-(4-fluorophenyl)ethyl]-5-methoxypentanamide.

Molecular Properties

Compound Name2-amino-N-[(1R)-1-(4-fluorophenyl)ethyl]-5-methoxypentanamide
PubChem CID81349504
Molecular FormulaC14H21FN2O2
Molecular Weight268.33 g/mol
Exact Mass268.16
IUPAC Name2-amino-N-[(1R)-1-(4-fluorophenyl)ethyl]-5-methoxypentanamide
SMILESCOCCCC(N)C(=O)N[C@H](C)c1ccc(F)cc1
InChIInChI=1S/C14H21FN2O2/c1-10(11-5-7-12(15)8-6-11)17-14(18)13(16)4-3-9-19-2/h5-8,10,13H,3-4,9,16H2,1-2H3,(H,17,18)/t10-,13?/m1/s1
InChIKeyWHDAIUWHPZTRFY-VUUHIHSGSA-N
XLogP1.76
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.33
LogP ≤ 51.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-amino-N-[(1S)-1-(4-fluorophenyl)ethyl]-4-methoxybutanamide
CID 81350017
2-amino-5-methoxy-N-[(1S)-1-(4-methoxyphenyl)ethyl]pentanamide
CID 81363764
2-amino-N-[1-(3,4-difluorophenyl)ethyl]-5-methoxypentanamide
CID 81082530
2-amino-N-[1-(4-ethoxyphenyl)ethyl]-5-methoxypentanamide
CID 81070435
(2R)-2-amino-N-[(1R)-1-(4-fluorophenyl)ethyl]butanamide
CID 81349306
2-amino-N-[1-(4-fluorophenyl)ethyl]-4-methylsulfonylbutanamide
CID 61249769
2-amino-4-methoxy-N-[(1S)-1-(4-methoxyphenyl)ethyl]butanamide
CID 81363996
2-amino-N-[(1R)-1-(4-fluorophenyl)ethyl]-4-methylpentanamide
CID 81348779
2-amino-N-[(1R)-1-(4-fluorophenyl)ethyl]propanamide
CID 81349591
6-amino-N-[1-(4-fluorophenyl)ethyl]-2-methylheptanamide
CID 65292258
2-amino-N-[1-(4-fluorophenyl)propan-2-yl]-4-methoxybutanamide
CID 63008409
2-amino-5-methoxy-N-(1-pyridin-2-ylethyl)pentanamide
CID 81081653

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[(1R)-1-(4-fluorophenyl)ethyl]-5-methoxypentanamide?
The IUPAC name of 2-amino-N-[(1R)-1-(4-fluorophenyl)ethyl]-5-methoxypentanamide (CID 81349504) is 2-amino-N-[(1R)-1-(4-fluorophenyl)ethyl]-5-methoxypentanamide.
What is the SMILES notation for 2-amino-N-[(1R)-1-(4-fluorophenyl)ethyl]-5-methoxypentanamide?
The canonical SMILES for 2-amino-N-[(1R)-1-(4-fluorophenyl)ethyl]-5-methoxypentanamide is COCCCC(N)C(=O)N[C@H](C)c1ccc(F)cc1.
What is the InChIKey of 2-amino-N-[(1R)-1-(4-fluorophenyl)ethyl]-5-methoxypentanamide?
The InChIKey is WHDAIUWHPZTRFY-VUUHIHSGSA-N. The full InChI is InChI=1S/C14H21FN2O2/c1-10(11-5-7-12(15)8-6-11)17-14(18)13(16)4-3-9-19-2/h5-8,10,13H,3-4,9,16H2,1-2H3,(H,17,18)/t10-,13?/m1/s1.
What are the key properties of 2-amino-N-[(1R)-1-(4-fluorophenyl)ethyl]-5-methoxypentanamide?
2-amino-N-[(1R)-1-(4-fluorophenyl)ethyl]-5-methoxypentanamide has a molecular weight of 268.33 g/mol, XLogP of 1.76, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[(1R)-1-(4-fluorophenyl)ethyl]-5-methoxypentanamide is sourced from PubChem (CID 81349504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).