2-amino-N-[2-(2-fluorophenyl)ethyl]-2-methylpentanamide;hydrochloride

C14H22ClFN2O — CID 119688573

IUPAC2-amino-N-[2-(2-fluorophenyl)ethyl]-2-methylpentanamide;hydrochloride
SMILESCCCC(C)(N)C(=O)NCCc1ccccc1F.Cl
InChIInChI=1S/C14H21FN2O.ClH/c1-3-9-14(2,16)13(18)17-10-8-11-6-4-5-7-12(11)15;/h4-7H,3,8-10,16H2,1-2H3,(H,17,18);1H
InChIKeyYSHYFCASVYBBDR-UHFFFAOYSA-N
MW288.79 g/mol
LogP2.42
Rot. Bonds6

About 2-amino-N-[2-(2-fluorophenyl)ethyl]-2-methylpentanamide;hydrochloride

2-amino-N-[2-(2-fluorophenyl)ethyl]-2-methylpentanamide;hydrochloride (PubChem CID 119688573) has the molecular formula C14H22ClFN2O and a molecular weight of 288.79 g/mol. Its IUPAC name is 2-amino-N-[2-(2-fluorophenyl)ethyl]-2-methylpentanamide;hydrochloride.

Molecular Properties

Compound Name2-amino-N-[2-(2-fluorophenyl)ethyl]-2-methylpentanamide;hydrochloride
PubChem CID119688573
Molecular FormulaC14H22ClFN2O
Molecular Weight288.79 g/mol
Exact Mass288.14
IUPAC Name2-amino-N-[2-(2-fluorophenyl)ethyl]-2-methylpentanamide;hydrochloride
SMILESCCCC(C)(N)C(=O)NCCc1ccccc1F.Cl
InChIInChI=1S/C14H21FN2O.ClH/c1-3-9-14(2,16)13(18)17-10-8-11-6-4-5-7-12(11)15;/h4-7H,3,8-10,16H2,1-2H3,(H,17,18);1H
InChIKeyYSHYFCASVYBBDR-UHFFFAOYSA-N
XLogP2.42
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.79
LogP ≤ 52.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-2-methyl-N-(2-naphthalen-1-ylethyl)pentanamide;hydrochloride
CID 119722534
2-amino-3,3,3-trifluoro-N-[2-(2-fluorophenyl)ethyl]-2-methylpropanamide
CID 79797317
2-amino-N-[2-(4-fluorophenyl)ethyl]-2-methylpentanamide
CID 60847510
2-amino-N-[2-(2,6-dimethylphenyl)ethyl]-2-methylpentanamide;hydrochloride
CID 119788074
2-amino-2-methyl-N-(3-phenylpropyl)pentanamide;hydrochloride
CID 119674817
2-amino-N-[2-(3-bromo-4-fluorophenyl)ethyl]-2-methylpentanamide
CID 119742406
2-amino-N-[(2-fluorophenyl)methyl]-2-methylbutanamide
CID 79796502
2-amino-2-methyl-N-[2-[4-(trifluoromethoxy)phenyl]ethyl]pentanamide;hydrochloride
CID 119721542
2-amino-2-methyl-N-(2-thiophen-2-ylethyl)pentanamide
CID 60847685
N-[2-(2-fluorophenyl)ethyl]propanamide
CID 22380876
2-amino-2-methyl-N-[[2-(trifluoromethyl)phenyl]methyl]pentanamide
CID 62880973
N-[2-(2-fluorophenyl)ethyl]-2,2-dimethyl-N'-propan-2-ylpropanediamide
CID 108957212

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[2-(2-fluorophenyl)ethyl]-2-methylpentanamide;hydrochloride?
The IUPAC name of 2-amino-N-[2-(2-fluorophenyl)ethyl]-2-methylpentanamide;hydrochloride (CID 119688573) is 2-amino-N-[2-(2-fluorophenyl)ethyl]-2-methylpentanamide;hydrochloride.
What is the SMILES notation for 2-amino-N-[2-(2-fluorophenyl)ethyl]-2-methylpentanamide;hydrochloride?
The canonical SMILES for 2-amino-N-[2-(2-fluorophenyl)ethyl]-2-methylpentanamide;hydrochloride is CCCC(C)(N)C(=O)NCCc1ccccc1F.Cl.
What is the InChIKey of 2-amino-N-[2-(2-fluorophenyl)ethyl]-2-methylpentanamide;hydrochloride?
The InChIKey is YSHYFCASVYBBDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21FN2O.ClH/c1-3-9-14(2,16)13(18)17-10-8-11-6-4-5-7-12(11)15;/h4-7H,3,8-10,16H2,1-2H3,(H,17,18);1H.
What are the key properties of 2-amino-N-[2-(2-fluorophenyl)ethyl]-2-methylpentanamide;hydrochloride?
2-amino-N-[2-(2-fluorophenyl)ethyl]-2-methylpentanamide;hydrochloride has a molecular weight of 288.79 g/mol, XLogP of 2.42, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[2-(2-fluorophenyl)ethyl]-2-methylpentanamide;hydrochloride is sourced from PubChem (CID 119688573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).