5-[2-(difluoromethoxy)phenyl]-1-[2-(dimethylamino)ethyl]-4,5-dihydroimidazol-2-amine

C14H20F2N4O — CID 79496716

IUPAC5-[2-(difluoromethoxy)phenyl]-1-[2-(dimethylamino)ethyl]-4,5-dihydroimidazol-2-amine
SMILESCN(C)CCN1C(N)=NCC1c1ccccc1OC(F)F
InChIInChI=1S/C14H20F2N4O/c1-19(2)7-8-20-11(9-18-14(20)17)10-5-3-4-6-12(10)21-13(15)16/h3-6,11,13H,7-9H2,1-2H3,(H2,17,18)
InChIKeyUYGQIUFCKHDEBU-UHFFFAOYSA-N
MW298.34 g/mol
LogP1.52
Rot. Bonds6

About 5-[2-(difluoromethoxy)phenyl]-1-[2-(dimethylamino)ethyl]-4,5-dihydroimidazol-2-amine

5-[2-(difluoromethoxy)phenyl]-1-[2-(dimethylamino)ethyl]-4,5-dihydroimidazol-2-amine (PubChem CID 79496716) has the molecular formula C14H20F2N4O and a molecular weight of 298.34 g/mol. Its IUPAC name is 5-[2-(difluoromethoxy)phenyl]-1-[2-(dimethylamino)ethyl]-4,5-dihydroimidazol-2-amine.

Molecular Properties

Compound Name5-[2-(difluoromethoxy)phenyl]-1-[2-(dimethylamino)ethyl]-4,5-dihydroimidazol-2-amine
PubChem CID79496716
Molecular FormulaC14H20F2N4O
Molecular Weight298.34 g/mol
Exact Mass298.16
IUPAC Name5-[2-(difluoromethoxy)phenyl]-1-[2-(dimethylamino)ethyl]-4,5-dihydroimidazol-2-amine
SMILESCN(C)CCN1C(N)=NCC1c1ccccc1OC(F)F
InChIInChI=1S/C14H20F2N4O/c1-19(2)7-8-20-11(9-18-14(20)17)10-5-3-4-6-12(10)21-13(15)16/h3-6,11,13H,7-9H2,1-2H3,(H2,17,18)
InChIKeyUYGQIUFCKHDEBU-UHFFFAOYSA-N
XLogP1.52
TPSA54.09 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.34
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-[2-(difluoromethoxy)phenyl]-1-[2-(dimethylamino)ethyl]-4,5-dihydroimidazol-2-amine?
The IUPAC name of 5-[2-(difluoromethoxy)phenyl]-1-[2-(dimethylamino)ethyl]-4,5-dihydroimidazol-2-amine (CID 79496716) is 5-[2-(difluoromethoxy)phenyl]-1-[2-(dimethylamino)ethyl]-4,5-dihydroimidazol-2-amine.
What is the SMILES notation for 5-[2-(difluoromethoxy)phenyl]-1-[2-(dimethylamino)ethyl]-4,5-dihydroimidazol-2-amine?
The canonical SMILES for 5-[2-(difluoromethoxy)phenyl]-1-[2-(dimethylamino)ethyl]-4,5-dihydroimidazol-2-amine is CN(C)CCN1C(N)=NCC1c1ccccc1OC(F)F.
What is the InChIKey of 5-[2-(difluoromethoxy)phenyl]-1-[2-(dimethylamino)ethyl]-4,5-dihydroimidazol-2-amine?
The InChIKey is UYGQIUFCKHDEBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20F2N4O/c1-19(2)7-8-20-11(9-18-14(20)17)10-5-3-4-6-12(10)21-13(15)16/h3-6,11,13H,7-9H2,1-2H3,(H2,17,18).
What are the key properties of 5-[2-(difluoromethoxy)phenyl]-1-[2-(dimethylamino)ethyl]-4,5-dihydroimidazol-2-amine?
5-[2-(difluoromethoxy)phenyl]-1-[2-(dimethylamino)ethyl]-4,5-dihydroimidazol-2-amine has a molecular weight of 298.34 g/mol, XLogP of 1.52, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-(difluoromethoxy)phenyl]-1-[2-(dimethylamino)ethyl]-4,5-dihydroimidazol-2-amine is sourced from PubChem (CID 79496716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).