2-amino-5-methoxy-N-[2-(trifluoromethyl)phenyl]pentanamide

C13H17F3N2O2 — CID 81082297

IUPAC2-amino-5-methoxy-N-[2-(trifluoromethyl)phenyl]pentanamide
SMILESCOCCCC(N)C(=O)Nc1ccccc1C(F)(F)F
InChIInChI=1S/C13H17F3N2O2/c1-20-8-4-6-10(17)12(19)18-11-7-3-2-5-9(11)13(14,15)16/h2-3,5,7,10H,4,6,8,17H2,1H3,(H,18,19)
InChIKeyFAZUMGCTDDNFDJ-UHFFFAOYSA-N
MW290.28 g/mol
LogP2.40
Rot. Bonds6

About 2-amino-5-methoxy-N-[2-(trifluoromethyl)phenyl]pentanamide

2-amino-5-methoxy-N-[2-(trifluoromethyl)phenyl]pentanamide (PubChem CID 81082297) has the molecular formula C13H17F3N2O2 and a molecular weight of 290.28 g/mol. Its IUPAC name is 2-amino-5-methoxy-N-[2-(trifluoromethyl)phenyl]pentanamide.

Molecular Properties

Compound Name2-amino-5-methoxy-N-[2-(trifluoromethyl)phenyl]pentanamide
PubChem CID81082297
Molecular FormulaC13H17F3N2O2
Molecular Weight290.28 g/mol
Exact Mass290.12
IUPAC Name2-amino-5-methoxy-N-[2-(trifluoromethyl)phenyl]pentanamide
SMILESCOCCCC(N)C(=O)Nc1ccccc1C(F)(F)F
InChIInChI=1S/C13H17F3N2O2/c1-20-8-4-6-10(17)12(19)18-11-7-3-2-5-9(11)13(14,15)16/h2-3,5,7,10H,4,6,8,17H2,1H3,(H,18,19)
InChIKeyFAZUMGCTDDNFDJ-UHFFFAOYSA-N
XLogP2.40
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.28
LogP ≤ 52.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2-amino-5-methoxy-N-[2-(trifluoromethyl)phenyl]pentanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-amino-N-[4-chloro-2-(trifluoromethyl)phenyl]-5-methoxypentanamide
CID 81084287
2-amino-N-(2-hydroxyphenyl)-5-methoxypentanamide
CID 81089431
2-[(2-amino-5-methoxypentanoyl)amino]benzamide
CID 81082219
2-amino-N-[2-(methanesulfonamido)phenyl]-5-methoxypentanamide
CID 81086132
methyl 3-[(2-amino-5-methoxypentanoyl)amino]-2-methylbenzoate
CID 81084760
2-amino-N-(2,5-difluorophenyl)-5-methoxypentanamide
CID 81081032
2-amino-N-(2-fluoro-5-methylphenyl)-5-methoxypentanamide
CID 81081841
2-methoxy-N-[2-(trifluoromethyl)phenyl]propanamide
CID 113225450
2-amino-N-benzyl-5-methoxypentanamide
CID 81081027
2-amino-N-[(2-hydroxyphenyl)methyl]-5-methoxypentanamide
CID 114332295
1-(4-amino-1-methoxybutan-2-yl)-3-[2-(trifluoromethyl)phenyl]urea
CID 106153716
2-[(2-amino-4-methoxybutanoyl)amino]benzamide
CID 55080862

Frequently Asked Questions

What is the IUPAC name of 2-amino-5-methoxy-N-[2-(trifluoromethyl)phenyl]pentanamide?
The IUPAC name of 2-amino-5-methoxy-N-[2-(trifluoromethyl)phenyl]pentanamide (CID 81082297) is 2-amino-5-methoxy-N-[2-(trifluoromethyl)phenyl]pentanamide.
What is the SMILES notation for 2-amino-5-methoxy-N-[2-(trifluoromethyl)phenyl]pentanamide?
The canonical SMILES for 2-amino-5-methoxy-N-[2-(trifluoromethyl)phenyl]pentanamide is COCCCC(N)C(=O)Nc1ccccc1C(F)(F)F.
What is the InChIKey of 2-amino-5-methoxy-N-[2-(trifluoromethyl)phenyl]pentanamide?
The InChIKey is FAZUMGCTDDNFDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17F3N2O2/c1-20-8-4-6-10(17)12(19)18-11-7-3-2-5-9(11)13(14,15)16/h2-3,5,7,10H,4,6,8,17H2,1H3,(H,18,19).
What are the key properties of 2-amino-5-methoxy-N-[2-(trifluoromethyl)phenyl]pentanamide?
2-amino-5-methoxy-N-[2-(trifluoromethyl)phenyl]pentanamide has a molecular weight of 290.28 g/mol, XLogP of 2.40, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-methoxy-N-[2-(trifluoromethyl)phenyl]pentanamide is sourced from PubChem (CID 81082297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).