1-(2,4-difluorophenyl)-2-(2-propylimidazol-1-yl)ethanamine

C14H17F2N3 — CID 107522682

IUPAC1-(2,4-difluorophenyl)-2-(2-propylimidazol-1-yl)ethanamine
SMILESCCCc1nccn1CC(N)c1ccc(F)cc1F
InChIInChI=1S/C14H17F2N3/c1-2-3-14-18-6-7-19(14)9-13(17)11-5-4-10(15)8-12(11)16/h4-8,13H,2-3,9,17H2,1H3
InChIKeyONULWCNDAWZFBF-UHFFFAOYSA-N
MW265.31 g/mol
LogP2.81
Rot. Bonds5

About 1-(2,4-difluorophenyl)-2-(2-propylimidazol-1-yl)ethanamine

1-(2,4-difluorophenyl)-2-(2-propylimidazol-1-yl)ethanamine (PubChem CID 107522682) has the molecular formula C14H17F2N3 and a molecular weight of 265.31 g/mol. Its IUPAC name is 1-(2,4-difluorophenyl)-2-(2-propylimidazol-1-yl)ethanamine.

Molecular Properties

Compound Name1-(2,4-difluorophenyl)-2-(2-propylimidazol-1-yl)ethanamine
PubChem CID107522682
Molecular FormulaC14H17F2N3
Molecular Weight265.31 g/mol
Exact Mass265.14
IUPAC Name1-(2,4-difluorophenyl)-2-(2-propylimidazol-1-yl)ethanamine
SMILESCCCc1nccn1CC(N)c1ccc(F)cc1F
InChIInChI=1S/C14H17F2N3/c1-2-3-14-18-6-7-19(14)9-13(17)11-5-4-10(15)8-12(11)16/h4-8,13H,2-3,9,17H2,1H3
InChIKeyONULWCNDAWZFBF-UHFFFAOYSA-N
XLogP2.81
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.31
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2,4-difluorophenyl)-2-(1-ethylimidazol-2-yl)ethanamine
CID 79752940
[1-(2,4-difluorophenyl)-2-(1-propylimidazol-2-yl)ethyl]hydrazine
CID 105216699
1-[2-amino-2-(2,4-difluorophenyl)ethyl]-3-methylpyridin-2-one
CID 107522608
2-(1-ethylimidazol-2-yl)-1-(5-fluoro-2-methylphenyl)ethanamine
CID 79751964
(2,4-difluorophenyl)-(1-ethylimidazol-2-yl)methanol
CID 61314416
1-(2,4-difluorophenyl)-2-(4-ethylpiperazin-1-yl)ethanamine
CID 16785018
1-(2,5-difluorophenyl)-N-ethyl-2-(1-propylimidazol-2-yl)ethanamine
CID 79751341
4-fluoro-2-[(2-propylimidazol-1-yl)methyl]benzenecarbothioamide
CID 64765991
5-[2-amino-2-(2,4-difluorophenyl)ethyl]pyrazolo[1,5-a]pyrazin-4-one
CID 107523095
1-[1-[(2,5-difluorophenyl)methyl]imidazol-2-yl]butan-2-amine
CID 63096712
2-(ethylamino)-3-(2-propylimidazol-1-yl)propan-1-ol
CID 64810250
2-(2-ethylimidazol-1-yl)-1-(2-methylphenyl)ethanamine
CID 61402571

Frequently Asked Questions

What is the IUPAC name of 1-(2,4-difluorophenyl)-2-(2-propylimidazol-1-yl)ethanamine?
The IUPAC name of 1-(2,4-difluorophenyl)-2-(2-propylimidazol-1-yl)ethanamine (CID 107522682) is 1-(2,4-difluorophenyl)-2-(2-propylimidazol-1-yl)ethanamine.
What is the SMILES notation for 1-(2,4-difluorophenyl)-2-(2-propylimidazol-1-yl)ethanamine?
The canonical SMILES for 1-(2,4-difluorophenyl)-2-(2-propylimidazol-1-yl)ethanamine is CCCc1nccn1CC(N)c1ccc(F)cc1F.
What is the InChIKey of 1-(2,4-difluorophenyl)-2-(2-propylimidazol-1-yl)ethanamine?
The InChIKey is ONULWCNDAWZFBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17F2N3/c1-2-3-14-18-6-7-19(14)9-13(17)11-5-4-10(15)8-12(11)16/h4-8,13H,2-3,9,17H2,1H3.
What are the key properties of 1-(2,4-difluorophenyl)-2-(2-propylimidazol-1-yl)ethanamine?
1-(2,4-difluorophenyl)-2-(2-propylimidazol-1-yl)ethanamine has a molecular weight of 265.31 g/mol, XLogP of 2.81, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4-difluorophenyl)-2-(2-propylimidazol-1-yl)ethanamine is sourced from PubChem (CID 107522682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).