5-(3,5-difluorophenyl)-3-ethyl-2-propan-2-ylimidazol-4-amine

C14H17F2N3 — CID 106531922

IUPAC5-(3,5-difluorophenyl)-3-ethyl-2-propan-2-ylimidazol-4-amine
SMILESCCn1c(C(C)C)nc(-c2cc(F)cc(F)c2)c1N
InChIInChI=1S/C14H17F2N3/c1-4-19-13(17)12(18-14(19)8(2)3)9-5-10(15)7-11(16)6-9/h5-8H,4,17H2,1-3H3
InChIKeyLCNSXIJWYDTLBU-UHFFFAOYSA-N
MW265.31 g/mol
LogP3.55
Rot. Bonds3

About 5-(3,5-difluorophenyl)-3-ethyl-2-propan-2-ylimidazol-4-amine

5-(3,5-difluorophenyl)-3-ethyl-2-propan-2-ylimidazol-4-amine (PubChem CID 106531922) has the molecular formula C14H17F2N3 and a molecular weight of 265.31 g/mol. Its IUPAC name is 5-(3,5-difluorophenyl)-3-ethyl-2-propan-2-ylimidazol-4-amine.

Molecular Properties

Compound Name5-(3,5-difluorophenyl)-3-ethyl-2-propan-2-ylimidazol-4-amine
PubChem CID106531922
Molecular FormulaC14H17F2N3
Molecular Weight265.31 g/mol
Exact Mass265.14
IUPAC Name5-(3,5-difluorophenyl)-3-ethyl-2-propan-2-ylimidazol-4-amine
SMILESCCn1c(C(C)C)nc(-c2cc(F)cc(F)c2)c1N
InChIInChI=1S/C14H17F2N3/c1-4-19-13(17)12(18-14(19)8(2)3)9-5-10(15)7-11(16)6-9/h5-8H,4,17H2,1-3H3
InChIKeyLCNSXIJWYDTLBU-UHFFFAOYSA-N
XLogP3.55
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.31
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 5-(3,5-difluorophenyl)-3-ethyl-2-propan-2-ylimidazol-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-(3,5-difluorophenyl)-2,3-di(propan-2-yl)imidazol-4-amine
CID 106531924
5-[3-(difluoromethyl)phenyl]-3-ethyl-2-propan-2-ylimidazol-4-amine
CID 115528289
3-ethyl-5-(3-methylphenyl)-2-propan-2-ylimidazol-4-amine
CID 62220327
3-ethyl-2-propan-2-yl-5-[4-(trifluoromethyl)phenyl]imidazol-4-amine
CID 62218375
5-(4-tert-butylphenyl)-3-ethyl-2-propan-2-ylimidazol-4-amine
CID 63469094
5-(3-chloro-2-fluorophenyl)-3-ethyl-2-propan-2-ylimidazol-4-amine
CID 114488594
5-(3-chloro-5-fluorophenyl)-2,3-di(propan-2-yl)imidazol-4-amine
CID 114454455
3-butyl-5-(3,5-dichlorophenyl)-2-propan-2-ylimidazol-4-amine
CID 63468374
5-(3,4-dimethylphenyl)-2-propan-2-yl-3-propylimidazol-4-amine
CID 63469456
3-butyl-5-(2,4-difluorophenyl)-2-propan-2-ylimidazol-4-amine
CID 62220167
5-(2-ethoxyphenyl)-3-ethyl-2-propan-2-ylimidazol-4-amine
CID 62219790
5-(1-ethylpyrazol-4-yl)-2-propan-2-yl-3-propylimidazol-4-amine
CID 103570396

Frequently Asked Questions

What is the IUPAC name of 5-(3,5-difluorophenyl)-3-ethyl-2-propan-2-ylimidazol-4-amine?
The IUPAC name of 5-(3,5-difluorophenyl)-3-ethyl-2-propan-2-ylimidazol-4-amine (CID 106531922) is 5-(3,5-difluorophenyl)-3-ethyl-2-propan-2-ylimidazol-4-amine.
What is the SMILES notation for 5-(3,5-difluorophenyl)-3-ethyl-2-propan-2-ylimidazol-4-amine?
The canonical SMILES for 5-(3,5-difluorophenyl)-3-ethyl-2-propan-2-ylimidazol-4-amine is CCn1c(C(C)C)nc(-c2cc(F)cc(F)c2)c1N.
What is the InChIKey of 5-(3,5-difluorophenyl)-3-ethyl-2-propan-2-ylimidazol-4-amine?
The InChIKey is LCNSXIJWYDTLBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17F2N3/c1-4-19-13(17)12(18-14(19)8(2)3)9-5-10(15)7-11(16)6-9/h5-8H,4,17H2,1-3H3.
What are the key properties of 5-(3,5-difluorophenyl)-3-ethyl-2-propan-2-ylimidazol-4-amine?
5-(3,5-difluorophenyl)-3-ethyl-2-propan-2-ylimidazol-4-amine has a molecular weight of 265.31 g/mol, XLogP of 3.55, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3,5-difluorophenyl)-3-ethyl-2-propan-2-ylimidazol-4-amine is sourced from PubChem (CID 106531922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).