1-cyclopropyl-5-ethyl-5-(3-fluorophenyl)-4H-imidazol-2-amine

C14H18FN3 — CID 114873226

IUPAC1-cyclopropyl-5-ethyl-5-(3-fluorophenyl)-4H-imidazol-2-amine
SMILESCCC1(c2cccc(F)c2)CN=C(N)N1C1CC1
InChIInChI=1S/C14H18FN3/c1-2-14(10-4-3-5-11(15)8-10)9-17-13(16)18(14)12-6-7-12/h3-5,8,12H,2,6-7,9H2,1H3,(H2,16,17)
InChIKeyBGHFJFYWNUVFRR-UHFFFAOYSA-N
MW247.32 g/mol
LogP2.22
Rot. Bonds3

About 1-cyclopropyl-5-ethyl-5-(3-fluorophenyl)-4H-imidazol-2-amine

1-cyclopropyl-5-ethyl-5-(3-fluorophenyl)-4H-imidazol-2-amine (PubChem CID 114873226) has the molecular formula C14H18FN3 and a molecular weight of 247.32 g/mol. Its IUPAC name is 1-cyclopropyl-5-ethyl-5-(3-fluorophenyl)-4H-imidazol-2-amine.

Molecular Properties

Compound Name1-cyclopropyl-5-ethyl-5-(3-fluorophenyl)-4H-imidazol-2-amine
PubChem CID114873226
Molecular FormulaC14H18FN3
Molecular Weight247.32 g/mol
Exact Mass247.15
IUPAC Name1-cyclopropyl-5-ethyl-5-(3-fluorophenyl)-4H-imidazol-2-amine
SMILESCCC1(c2cccc(F)c2)CN=C(N)N1C1CC1
InChIInChI=1S/C14H18FN3/c1-2-14(10-4-3-5-11(15)8-10)9-17-13(16)18(14)12-6-7-12/h3-5,8,12H,2,6-7,9H2,1H3,(H2,16,17)
InChIKeyBGHFJFYWNUVFRR-UHFFFAOYSA-N
XLogP2.22
TPSA41.62 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.32
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-cyclopropyl-5,5-diethyl-4H-imidazol-2-amine
CID 79509325
5-(3-fluorophenyl)-5-methyl-1-prop-2-enyl-4H-imidazol-2-amine
CID 79498707
1-(3-fluorophenyl)-5,5-dipropyl-4H-imidazol-2-amine
CID 79514797
1-(4-chlorophenyl)-5-(3-fluorophenyl)-5-methyl-4H-imidazol-2-amine
CID 79502372
5-(3-chlorophenyl)-1-cycloheptyl-5-methyl-4H-imidazol-2-amine
CID 79498841
1-cyclopropyl-5-ethyl-5-(methoxymethyl)-4H-imidazol-2-amine
CID 79510430
1-cyclopropyl-5-(3,4-dimethylphenyl)-5-methyl-4H-imidazol-2-amine
CID 79509537
[2-ethyl-2-(3-fluorophenyl)cyclopropyl]methanamine
CID 114872926
5-(3-fluorophenyl)-5-methyl-1,4-dihydroimidazol-2-amine
CID 79509455
5-(5-bromo-2-fluorophenyl)-1-cyclopropyl-5-methyl-4H-imidazol-2-amine
CID 82973719
5-ethyl-5-(4-ethylphenyl)-1-propyl-4H-imidazol-2-amine
CID 79509520
9-ethyl-1-(3-fluorophenyl)-1,3,9-triazaspiro[4.6]undec-2-en-2-amine
CID 79503079

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-5-ethyl-5-(3-fluorophenyl)-4H-imidazol-2-amine?
The IUPAC name of 1-cyclopropyl-5-ethyl-5-(3-fluorophenyl)-4H-imidazol-2-amine (CID 114873226) is 1-cyclopropyl-5-ethyl-5-(3-fluorophenyl)-4H-imidazol-2-amine.
What is the SMILES notation for 1-cyclopropyl-5-ethyl-5-(3-fluorophenyl)-4H-imidazol-2-amine?
The canonical SMILES for 1-cyclopropyl-5-ethyl-5-(3-fluorophenyl)-4H-imidazol-2-amine is CCC1(c2cccc(F)c2)CN=C(N)N1C1CC1.
What is the InChIKey of 1-cyclopropyl-5-ethyl-5-(3-fluorophenyl)-4H-imidazol-2-amine?
The InChIKey is BGHFJFYWNUVFRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18FN3/c1-2-14(10-4-3-5-11(15)8-10)9-17-13(16)18(14)12-6-7-12/h3-5,8,12H,2,6-7,9H2,1H3,(H2,16,17).
What are the key properties of 1-cyclopropyl-5-ethyl-5-(3-fluorophenyl)-4H-imidazol-2-amine?
1-cyclopropyl-5-ethyl-5-(3-fluorophenyl)-4H-imidazol-2-amine has a molecular weight of 247.32 g/mol, XLogP of 2.22, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-5-ethyl-5-(3-fluorophenyl)-4H-imidazol-2-amine is sourced from PubChem (CID 114873226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).