3-cyclopropyl-5-[4-(difluoromethyl)phenyl]-2-propylimidazol-4-amine

C16H19F2N3 — CID 115525224

IUPAC3-cyclopropyl-5-[4-(difluoromethyl)phenyl]-2-propylimidazol-4-amine
SMILESCCCc1nc(-c2ccc(C(F)F)cc2)c(N)n1C1CC1
InChIInChI=1S/C16H19F2N3/c1-2-3-13-20-14(16(19)21(13)12-8-9-12)10-4-6-11(7-5-10)15(17)18/h4-7,12,15H,2-3,8-9,19H2,1H3
InChIKeyFWYIGUYSJUDXAB-UHFFFAOYSA-N
MW291.35 g/mol
LogP4.36
Rot. Bonds5

About 3-cyclopropyl-5-[4-(difluoromethyl)phenyl]-2-propylimidazol-4-amine

3-cyclopropyl-5-[4-(difluoromethyl)phenyl]-2-propylimidazol-4-amine (PubChem CID 115525224) has the molecular formula C16H19F2N3 and a molecular weight of 291.35 g/mol. Its IUPAC name is 3-cyclopropyl-5-[4-(difluoromethyl)phenyl]-2-propylimidazol-4-amine.

Molecular Properties

Compound Name3-cyclopropyl-5-[4-(difluoromethyl)phenyl]-2-propylimidazol-4-amine
PubChem CID115525224
Molecular FormulaC16H19F2N3
Molecular Weight291.35 g/mol
Exact Mass291.15
IUPAC Name3-cyclopropyl-5-[4-(difluoromethyl)phenyl]-2-propylimidazol-4-amine
SMILESCCCc1nc(-c2ccc(C(F)F)cc2)c(N)n1C1CC1
InChIInChI=1S/C16H19F2N3/c1-2-3-13-20-14(16(19)21(13)12-8-9-12)10-4-6-11(7-5-10)15(17)18/h4-7,12,15H,2-3,8-9,19H2,1H3
InChIKeyFWYIGUYSJUDXAB-UHFFFAOYSA-N
XLogP4.36
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.35
LogP ≤ 54.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-cyclopropyl-5-[4-(difluoromethyl)phenyl]-2-methylimidazol-4-amine
CID 115525205
3-cyclopropyl-5-(3,4-difluorophenyl)-2-propylimidazol-4-amine
CID 62218355
3-cyclopropyl-2-ethyl-5-(4-methylphenyl)imidazol-4-amine
CID 55048823
3-cyclopropyl-2-propyl-5-(3,4,5-trifluorophenyl)imidazol-4-amine
CID 63050859
5-(3-bromo-4-methoxyphenyl)-3-cyclopropyl-2-propylimidazol-4-amine
CID 62219065
3-cyclopropyl-2-ethyl-5-phenylimidazol-4-amine
CID 62220629
3-cyclopropyl-2-ethyl-5-(4-propoxyphenyl)imidazol-4-amine
CID 62495279
3-cyclopropyl-5-propan-2-yl-2-propylimidazol-4-amine
CID 62218882
3-cyclopropyl-5-(3-ethylimidazol-4-yl)-2-propylimidazol-4-amine
CID 66135479
3-cyclopropyl-2-propyl-5-(3-propylimidazol-4-yl)imidazol-4-amine
CID 66129550
5-(4-fluorophenyl)-3-methyl-2-propylimidazol-4-amine
CID 62220284
4-[4-(difluoromethyl)phenyl]-2-methylimidazole-1,5-diamine
CID 113328558

Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-5-[4-(difluoromethyl)phenyl]-2-propylimidazol-4-amine?
The IUPAC name of 3-cyclopropyl-5-[4-(difluoromethyl)phenyl]-2-propylimidazol-4-amine (CID 115525224) is 3-cyclopropyl-5-[4-(difluoromethyl)phenyl]-2-propylimidazol-4-amine.
What is the SMILES notation for 3-cyclopropyl-5-[4-(difluoromethyl)phenyl]-2-propylimidazol-4-amine?
The canonical SMILES for 3-cyclopropyl-5-[4-(difluoromethyl)phenyl]-2-propylimidazol-4-amine is CCCc1nc(-c2ccc(C(F)F)cc2)c(N)n1C1CC1.
What is the InChIKey of 3-cyclopropyl-5-[4-(difluoromethyl)phenyl]-2-propylimidazol-4-amine?
The InChIKey is FWYIGUYSJUDXAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19F2N3/c1-2-3-13-20-14(16(19)21(13)12-8-9-12)10-4-6-11(7-5-10)15(17)18/h4-7,12,15H,2-3,8-9,19H2,1H3.
What are the key properties of 3-cyclopropyl-5-[4-(difluoromethyl)phenyl]-2-propylimidazol-4-amine?
3-cyclopropyl-5-[4-(difluoromethyl)phenyl]-2-propylimidazol-4-amine has a molecular weight of 291.35 g/mol, XLogP of 4.36, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-5-[4-(difluoromethyl)phenyl]-2-propylimidazol-4-amine is sourced from PubChem (CID 115525224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).