2-amino-N-[2-(4-fluorophenoxy)ethyl]-N,2-dimethylpentanamide

C15H23FN2O2 — CID 60938123

IUPAC2-amino-N-[2-(4-fluorophenoxy)ethyl]-N,2-dimethylpentanamide
SMILESCCCC(C)(N)C(=O)N(C)CCOc1ccc(F)cc1
InChIInChI=1S/C15H23FN2O2/c1-4-9-15(2,17)14(19)18(3)10-11-20-13-7-5-12(16)6-8-13/h5-8H,4,9-11,17H2,1-3H3
InChIKeyPSCHFGLXPGTXIP-UHFFFAOYSA-N
MW282.36 g/mol
LogP2.18
Rot. Bonds7

About 2-amino-N-[2-(4-fluorophenoxy)ethyl]-N,2-dimethylpentanamide

2-amino-N-[2-(4-fluorophenoxy)ethyl]-N,2-dimethylpentanamide (PubChem CID 60938123) has the molecular formula C15H23FN2O2 and a molecular weight of 282.36 g/mol. Its IUPAC name is 2-amino-N-[2-(4-fluorophenoxy)ethyl]-N,2-dimethylpentanamide.

Molecular Properties

Compound Name2-amino-N-[2-(4-fluorophenoxy)ethyl]-N,2-dimethylpentanamide
PubChem CID60938123
Molecular FormulaC15H23FN2O2
Molecular Weight282.36 g/mol
Exact Mass282.17
IUPAC Name2-amino-N-[2-(4-fluorophenoxy)ethyl]-N,2-dimethylpentanamide
SMILESCCCC(C)(N)C(=O)N(C)CCOc1ccc(F)cc1
InChIInChI=1S/C15H23FN2O2/c1-4-9-15(2,17)14(19)18(3)10-11-20-13-7-5-12(16)6-8-13/h5-8H,4,9-11,17H2,1-3H3
InChIKeyPSCHFGLXPGTXIP-UHFFFAOYSA-N
XLogP2.18
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.36
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-[2-(4-bromophenoxy)ethyl]-N,2-dimethylpentanamide
CID 60937668
2-amino-N,2-dimethyl-N-[2-(4-methylphenoxy)ethyl]pentanamide;hydrochloride
CID 119695424
2-amino-N,2-dimethyl-N-[2-(3-methylphenoxy)ethyl]pentanamide;hydrochloride
CID 119695698
2-(aminomethyl)-2-ethyl-N-[2-(4-fluorophenoxy)ethyl]-N-methylbutanamide
CID 115432041
2-amino-N-[4-[2-(dimethylamino)ethoxy]phenyl]-2-methylpentanamide
CID 60928090
2-amino-N-[2-(4-chlorophenoxy)ethyl]-3,3,3-trifluoro-N,2-dimethylpropanamide
CID 79793142
2-bromo-N-[2-(4-chlorophenoxy)ethyl]-N,2-dimethylpropanamide
CID 115649486
N-[2-(4-fluorophenoxy)ethyl]-N-methylhexanamide
CID 86909745
1-amino-N-[2-(4-fluorophenoxy)ethyl]-N-methylcyclopropane-1-carboxamide
CID 65464033
2-amino-N-[2-(2-fluorophenoxy)ethyl]-N,2-dimethylbutanamide
CID 79805740
(2R)-2-amino-N-[2-(4-fluorophenoxy)ethyl]-N-methylpropanamide
CID 54995498
2-amino-N-[2-(4-bromophenoxy)ethyl]-N,2-dimethylpropanamide
CID 61266801

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[2-(4-fluorophenoxy)ethyl]-N,2-dimethylpentanamide?
The IUPAC name of 2-amino-N-[2-(4-fluorophenoxy)ethyl]-N,2-dimethylpentanamide (CID 60938123) is 2-amino-N-[2-(4-fluorophenoxy)ethyl]-N,2-dimethylpentanamide.
What is the SMILES notation for 2-amino-N-[2-(4-fluorophenoxy)ethyl]-N,2-dimethylpentanamide?
The canonical SMILES for 2-amino-N-[2-(4-fluorophenoxy)ethyl]-N,2-dimethylpentanamide is CCCC(C)(N)C(=O)N(C)CCOc1ccc(F)cc1.
What is the InChIKey of 2-amino-N-[2-(4-fluorophenoxy)ethyl]-N,2-dimethylpentanamide?
The InChIKey is PSCHFGLXPGTXIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23FN2O2/c1-4-9-15(2,17)14(19)18(3)10-11-20-13-7-5-12(16)6-8-13/h5-8H,4,9-11,17H2,1-3H3.
What are the key properties of 2-amino-N-[2-(4-fluorophenoxy)ethyl]-N,2-dimethylpentanamide?
2-amino-N-[2-(4-fluorophenoxy)ethyl]-N,2-dimethylpentanamide has a molecular weight of 282.36 g/mol, XLogP of 2.18, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[2-(4-fluorophenoxy)ethyl]-N,2-dimethylpentanamide is sourced from PubChem (CID 60938123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).