2-amino-N-[3-[(4-fluorophenyl)methoxy]phenyl]pentanamide;hydrochloride

C18H22ClFN2O2 — CID 119284258

IUPAC2-amino-N-[3-[(4-fluorophenyl)methoxy]phenyl]pentanamide;hydrochloride
SMILESCCCC(N)C(=O)Nc1cccc(OCc2ccc(F)cc2)c1.Cl
InChIInChI=1S/C18H21FN2O2.ClH/c1-2-4-17(20)18(22)21-15-5-3-6-16(11-15)23-12-13-7-9-14(19)10-8-13;/h3,5-11,17H,2,4,12,20H2,1H3,(H,21,22);1H
InChIKeyIXSDFAVSIGYUFX-UHFFFAOYSA-N
MW352.84 g/mol
LogP3.89
Rot. Bonds7

About 2-amino-N-[3-[(4-fluorophenyl)methoxy]phenyl]pentanamide;hydrochloride

2-amino-N-[3-[(4-fluorophenyl)methoxy]phenyl]pentanamide;hydrochloride (PubChem CID 119284258) has the molecular formula C18H22ClFN2O2 and a molecular weight of 352.84 g/mol. Its IUPAC name is 2-amino-N-[3-[(4-fluorophenyl)methoxy]phenyl]pentanamide;hydrochloride.

Molecular Properties

Compound Name2-amino-N-[3-[(4-fluorophenyl)methoxy]phenyl]pentanamide;hydrochloride
PubChem CID119284258
Molecular FormulaC18H22ClFN2O2
Molecular Weight352.84 g/mol
Exact Mass352.14
IUPAC Name2-amino-N-[3-[(4-fluorophenyl)methoxy]phenyl]pentanamide;hydrochloride
SMILESCCCC(N)C(=O)Nc1cccc(OCc2ccc(F)cc2)c1.Cl
InChIInChI=1S/C18H21FN2O2.ClH/c1-2-4-17(20)18(22)21-15-5-3-6-16(11-15)23-12-13-7-9-14(19)10-8-13;/h3,5-11,17H,2,4,12,20H2,1H3,(H,21,22);1H
InChIKeyIXSDFAVSIGYUFX-UHFFFAOYSA-N
XLogP3.89
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.84
LogP ≤ 53.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-amino-N-[3-(2-methylpropoxy)phenyl]pentanamide
CID 93360101
2-amino-N-(4-phenylmethoxyphenyl)pentanamide;hydrochloride
CID 119261538
2-amino-N-(3-butan-2-yloxyphenyl)pentanamide
CID 55059966
2-amino-N-(3-ethylphenyl)pentanamide;hydrochloride
CID 119263935
2-amino-N-[3-(1,3-benzodioxol-5-yloxymethyl)phenyl]pentanamide
CID 119292475
[(2R)-2-amino-3-oxo-3-(3-phenylmethoxyanilino)propyl] 2,2,2-trifluoroacetate
CID 135386519
(2R)-2-amino-N-(3-ethylphenyl)pentanamide
CID 103793845
2-amino-N-[[4-[(3-fluorophenyl)methoxy]phenyl]methyl]pentanamide;hydrochloride
CID 119283180
(2S)-2-amino-N-[3-(2-amino-2-oxoethoxy)phenyl]hexanamide
CID 103831187
4-amino-N-[3-[(4-fluorophenyl)methoxy]phenyl]-3-methoxybutanamide
CID 120588341
(2S)-2-amino-N-[3-(hydroxymethyl)phenyl]pentanamide
CID 107568565
3-amino-4-oxo-4-(3-propoxyanilino)butanoic acid
CID 64894519

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[3-[(4-fluorophenyl)methoxy]phenyl]pentanamide;hydrochloride?
The IUPAC name of 2-amino-N-[3-[(4-fluorophenyl)methoxy]phenyl]pentanamide;hydrochloride (CID 119284258) is 2-amino-N-[3-[(4-fluorophenyl)methoxy]phenyl]pentanamide;hydrochloride.
What is the SMILES notation for 2-amino-N-[3-[(4-fluorophenyl)methoxy]phenyl]pentanamide;hydrochloride?
The canonical SMILES for 2-amino-N-[3-[(4-fluorophenyl)methoxy]phenyl]pentanamide;hydrochloride is CCCC(N)C(=O)Nc1cccc(OCc2ccc(F)cc2)c1.Cl.
What is the InChIKey of 2-amino-N-[3-[(4-fluorophenyl)methoxy]phenyl]pentanamide;hydrochloride?
The InChIKey is IXSDFAVSIGYUFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21FN2O2.ClH/c1-2-4-17(20)18(22)21-15-5-3-6-16(11-15)23-12-13-7-9-14(19)10-8-13;/h3,5-11,17H,2,4,12,20H2,1H3,(H,21,22);1H.
What are the key properties of 2-amino-N-[3-[(4-fluorophenyl)methoxy]phenyl]pentanamide;hydrochloride?
2-amino-N-[3-[(4-fluorophenyl)methoxy]phenyl]pentanamide;hydrochloride has a molecular weight of 352.84 g/mol, XLogP of 3.89, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[3-[(4-fluorophenyl)methoxy]phenyl]pentanamide;hydrochloride is sourced from PubChem (CID 119284258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).