5-(4-fluorophenyl)-1-methyl-4,5-dihydroimidazol-2-amine

C10H12FN3 — CID 79510699

IUPAC5-(4-fluorophenyl)-1-methyl-4,5-dihydroimidazol-2-amine
SMILESCN1C(N)=NCC1c1ccc(F)cc1
InChIInChI=1S/C10H12FN3/c1-14-9(6-13-10(14)12)7-2-4-8(11)5-3-7/h2-5,9H,6H2,1H3,(H2,12,13)
InChIKeyDBFDRIFZVMPWCO-UHFFFAOYSA-N
MW193.22 g/mol
LogP1.13
Rot. Bonds1

About 5-(4-fluorophenyl)-1-methyl-4,5-dihydroimidazol-2-amine

5-(4-fluorophenyl)-1-methyl-4,5-dihydroimidazol-2-amine (PubChem CID 79510699) has the molecular formula C10H12FN3 and a molecular weight of 193.22 g/mol. Its IUPAC name is 5-(4-fluorophenyl)-1-methyl-4,5-dihydroimidazol-2-amine.

Molecular Properties

Compound Name5-(4-fluorophenyl)-1-methyl-4,5-dihydroimidazol-2-amine
PubChem CID79510699
Molecular FormulaC10H12FN3
Molecular Weight193.22 g/mol
Exact Mass193.10
IUPAC Name5-(4-fluorophenyl)-1-methyl-4,5-dihydroimidazol-2-amine
SMILESCN1C(N)=NCC1c1ccc(F)cc1
InChIInChI=1S/C10H12FN3/c1-14-9(6-13-10(14)12)7-2-4-8(11)5-3-7/h2-5,9H,6H2,1H3,(H2,12,13)
InChIKeyDBFDRIFZVMPWCO-UHFFFAOYSA-N
XLogP1.13
TPSA41.62 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.22
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

Bethanidine
CID 2368
1H-Imidazol-2-amine, 4,5-dihydro-4-phenyl-
CID 11298130
1-(2-Phenylethyl)-4,5-dihydroimidazol-2-amine
CID 17928801
1-[2-(3-Fluorophenyl)ethyl]-4,5-dihydroimidazol-2-amine
CID 135386427
(5S)-1-[2-(3-fluorophenyl)ethyl]-5-methyl-4,5-dihydroimidazol-2-amine
CID 135386625
(2-Amino-1-(4-fluorophenyl)ethyl)dimethylamine
CID 3163525
Deximafen
CID 163316
(5S)-5-benzyl-1-heptyl-N,N-dimethyl-4,5-dihydroimidazol-2-amine
CID 25102542
(5S)-5-benzyl-1-ethyl-N,N-dimethyl-4,5-dihydroimidazol-2-amine
CID 25102548
(5S)-N,N,5-trimethyl-1-(4-phenylbutyl)-4,5-dihydroimidazol-2-amine
CID 25102695
4-(2-Chlorophenyl)-1-methyl-4,5-dihydroimidazol-2-amine
CID 44371633
(5S)-5-methyl-1-(2-phenylethyl)-4,5-dihydroimidazol-2-amine
CID 135386347

Frequently Asked Questions

What is the IUPAC name of 5-(4-fluorophenyl)-1-methyl-4,5-dihydroimidazol-2-amine?
The IUPAC name of 5-(4-fluorophenyl)-1-methyl-4,5-dihydroimidazol-2-amine (CID 79510699) is 5-(4-fluorophenyl)-1-methyl-4,5-dihydroimidazol-2-amine.
What is the SMILES notation for 5-(4-fluorophenyl)-1-methyl-4,5-dihydroimidazol-2-amine?
The canonical SMILES for 5-(4-fluorophenyl)-1-methyl-4,5-dihydroimidazol-2-amine is CN1C(N)=NCC1c1ccc(F)cc1.
What is the InChIKey of 5-(4-fluorophenyl)-1-methyl-4,5-dihydroimidazol-2-amine?
The InChIKey is DBFDRIFZVMPWCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12FN3/c1-14-9(6-13-10(14)12)7-2-4-8(11)5-3-7/h2-5,9H,6H2,1H3,(H2,12,13).
What are the key properties of 5-(4-fluorophenyl)-1-methyl-4,5-dihydroimidazol-2-amine?
5-(4-fluorophenyl)-1-methyl-4,5-dihydroimidazol-2-amine has a molecular weight of 193.22 g/mol, XLogP of 1.13, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-fluorophenyl)-1-methyl-4,5-dihydroimidazol-2-amine is sourced from PubChem (CID 79510699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).