2-amino-N-[1-(2,4-difluorophenyl)propyl]acetamide

C11H14F2N2O — CID 119330686

IUPAC2-amino-N-[1-(2,4-difluorophenyl)propyl]acetamide
SMILESCCC(NC(=O)CN)c1ccc(F)cc1F
InChIInChI=1S/C11H14F2N2O/c1-2-10(15-11(16)6-14)8-4-3-7(12)5-9(8)13/h3-5,10H,2,6,14H2,1H3,(H,15,16)
InChIKeyZIGQKZYJIIBLDD-UHFFFAOYSA-N
MW228.24 g/mol
LogP1.49
Rot. Bonds4

About 2-amino-N-[1-(2,4-difluorophenyl)propyl]acetamide

2-amino-N-[1-(2,4-difluorophenyl)propyl]acetamide (PubChem CID 119330686) has the molecular formula C11H14F2N2O and a molecular weight of 228.24 g/mol. Its IUPAC name is 2-amino-N-[1-(2,4-difluorophenyl)propyl]acetamide.

Molecular Properties

Compound Name2-amino-N-[1-(2,4-difluorophenyl)propyl]acetamide
PubChem CID119330686
Molecular FormulaC11H14F2N2O
Molecular Weight228.24 g/mol
Exact Mass228.11
IUPAC Name2-amino-N-[1-(2,4-difluorophenyl)propyl]acetamide
SMILESCCC(NC(=O)CN)c1ccc(F)cc1F
InChIInChI=1S/C11H14F2N2O/c1-2-10(15-11(16)6-14)8-4-3-7(12)5-9(8)13/h3-5,10H,2,6,14H2,1H3,(H,15,16)
InChIKeyZIGQKZYJIIBLDD-UHFFFAOYSA-N
XLogP1.49
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.24
LogP ≤ 51.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-amino-N-[1-(2,4-difluorophenyl)propyl]propanamide
CID 119330684
4-amino-N-[1-(2,4-difluorophenyl)propyl]-3-methoxybutanamide;hydrochloride
CID 120592889
3-amino-N-[1-(2,5-difluorophenyl)propyl]propanamide
CID 119333169
3-(2-aminophenyl)-N-[1-(2,4-difluorophenyl)propyl]propanamide;hydrochloride
CID 120611087
2-amino-N-[1-(2,4-difluorophenyl)propyl]-2-methylpentanamide;hydrochloride
CID 119796320
4-(aminomethyl)-N-[1-(2,4-difluorophenyl)propyl]oxane-4-carboxamide
CID 120934203
3-amino-N-[1-(2,4-difluorophenyl)propyl]bicyclo[2.2.1]heptane-2-carboxamide
CID 119796283
4-amino-N-[1-(2,5-difluorophenyl)propyl]-3-methoxybutanamide
CID 120593154
3-amino-N-[1-(2,4-difluorophenyl)propyl]-2-methyl-3-phenylpropanamide
CID 119796287
1-(2,4-difluorophenyl)-N-propan-2-ylpropan-1-amine
CID 115641478
3-acetamido-N-(2-aminoethyl)-3-(2,4-difluorophenyl)propanamide
CID 119382823
3-(aminomethyl)-N-[1-(2,4-difluorophenyl)ethyl]pentanamide
CID 81075854

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[1-(2,4-difluorophenyl)propyl]acetamide?
The IUPAC name of 2-amino-N-[1-(2,4-difluorophenyl)propyl]acetamide (CID 119330686) is 2-amino-N-[1-(2,4-difluorophenyl)propyl]acetamide.
What is the SMILES notation for 2-amino-N-[1-(2,4-difluorophenyl)propyl]acetamide?
The canonical SMILES for 2-amino-N-[1-(2,4-difluorophenyl)propyl]acetamide is CCC(NC(=O)CN)c1ccc(F)cc1F.
What is the InChIKey of 2-amino-N-[1-(2,4-difluorophenyl)propyl]acetamide?
The InChIKey is ZIGQKZYJIIBLDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14F2N2O/c1-2-10(15-11(16)6-14)8-4-3-7(12)5-9(8)13/h3-5,10H,2,6,14H2,1H3,(H,15,16).
What are the key properties of 2-amino-N-[1-(2,4-difluorophenyl)propyl]acetamide?
2-amino-N-[1-(2,4-difluorophenyl)propyl]acetamide has a molecular weight of 228.24 g/mol, XLogP of 1.49, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[1-(2,4-difluorophenyl)propyl]acetamide is sourced from PubChem (CID 119330686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).