N-[2-(2,6-difluorophenyl)phenyl]-4,5-dihydro-1H-imidazol-2-amine

C15H13F2N3 — CID 15175561

IUPACN-[2-(2,6-difluorophenyl)phenyl]-4,5-dihydro-1H-imidazol-2-amine
SMILESFc1cccc(F)c1-c1ccccc1NC1=NCCN1
InChIInChI=1S/C15H13F2N3/c16-11-5-3-6-12(17)14(11)10-4-1-2-7-13(10)20-15-18-8-9-19-15/h1-7H,8-9H2,(H2,18,19,20)
InChIKeyYDIALYKHSDDVFU-UHFFFAOYSA-N
MW273.29 g/mol
LogP3.00
Rot. Bonds2

About N-[2-(2,6-difluorophenyl)phenyl]-4,5-dihydro-1H-imidazol-2-amine

N-[2-(2,6-difluorophenyl)phenyl]-4,5-dihydro-1H-imidazol-2-amine (PubChem CID 15175561) has the molecular formula C15H13F2N3 and a molecular weight of 273.29 g/mol. Its IUPAC name is N-[2-(2,6-difluorophenyl)phenyl]-4,5-dihydro-1H-imidazol-2-amine.

Molecular Properties

Compound NameN-[2-(2,6-difluorophenyl)phenyl]-4,5-dihydro-1H-imidazol-2-amine
PubChem CID15175561
Molecular FormulaC15H13F2N3
Molecular Weight273.29 g/mol
Exact Mass273.11
IUPAC NameN-[2-(2,6-difluorophenyl)phenyl]-4,5-dihydro-1H-imidazol-2-amine
SMILESFc1cccc(F)c1-c1ccccc1NC1=NCCN1
InChIInChI=1S/C15H13F2N3/c16-11-5-3-6-12(17)14(11)10-4-1-2-7-13(10)20-15-18-8-9-19-15/h1-7H,8-9H2,(H2,18,19,20)
InChIKeyYDIALYKHSDDVFU-UHFFFAOYSA-N
XLogP3.00
TPSA36.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.29
LogP ≤ 53.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[2-(2,6-difluorophenyl)phenyl]-4,5-dihydro-1H-imidazol-2-amine?
The IUPAC name of N-[2-(2,6-difluorophenyl)phenyl]-4,5-dihydro-1H-imidazol-2-amine (CID 15175561) is N-[2-(2,6-difluorophenyl)phenyl]-4,5-dihydro-1H-imidazol-2-amine.
What is the SMILES notation for N-[2-(2,6-difluorophenyl)phenyl]-4,5-dihydro-1H-imidazol-2-amine?
The canonical SMILES for N-[2-(2,6-difluorophenyl)phenyl]-4,5-dihydro-1H-imidazol-2-amine is Fc1cccc(F)c1-c1ccccc1NC1=NCCN1.
What is the InChIKey of N-[2-(2,6-difluorophenyl)phenyl]-4,5-dihydro-1H-imidazol-2-amine?
The InChIKey is YDIALYKHSDDVFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13F2N3/c16-11-5-3-6-12(17)14(11)10-4-1-2-7-13(10)20-15-18-8-9-19-15/h1-7H,8-9H2,(H2,18,19,20).
What are the key properties of N-[2-(2,6-difluorophenyl)phenyl]-4,5-dihydro-1H-imidazol-2-amine?
N-[2-(2,6-difluorophenyl)phenyl]-4,5-dihydro-1H-imidazol-2-amine has a molecular weight of 273.29 g/mol, XLogP of 3.00, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2,6-difluorophenyl)phenyl]-4,5-dihydro-1H-imidazol-2-amine is sourced from PubChem (CID 15175561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).