4-(2-fluoro-4,6-dimethylphenyl)-6-imidazol-1-yl-1,3,5-triazin-2-amine

C14H13FN6 — CID 106882750

IUPAC4-(2-fluoro-4,6-dimethylphenyl)-6-imidazol-1-yl-1,3,5-triazin-2-amine
SMILESCc1cc(C)c(-c2nc(N)nc(-n3ccnc3)n2)c(F)c1
InChIInChI=1S/C14H13FN6/c1-8-5-9(2)11(10(15)6-8)12-18-13(16)20-14(19-12)21-4-3-17-7-21/h3-7H,1-2H3,(H2,16,18,19,20)
InChIKeyQAPMQRHHMSDZKM-UHFFFAOYSA-N
MW284.30 g/mol
LogP2.06
Rot. Bonds2

About 4-(2-fluoro-4,6-dimethylphenyl)-6-imidazol-1-yl-1,3,5-triazin-2-amine

4-(2-fluoro-4,6-dimethylphenyl)-6-imidazol-1-yl-1,3,5-triazin-2-amine (PubChem CID 106882750) has the molecular formula C14H13FN6 and a molecular weight of 284.30 g/mol. Its IUPAC name is 4-(2-fluoro-4,6-dimethylphenyl)-6-imidazol-1-yl-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-(2-fluoro-4,6-dimethylphenyl)-6-imidazol-1-yl-1,3,5-triazin-2-amine
PubChem CID106882750
Molecular FormulaC14H13FN6
Molecular Weight284.30 g/mol
Exact Mass284.12
IUPAC Name4-(2-fluoro-4,6-dimethylphenyl)-6-imidazol-1-yl-1,3,5-triazin-2-amine
SMILESCc1cc(C)c(-c2nc(N)nc(-n3ccnc3)n2)c(F)c1
InChIInChI=1S/C14H13FN6/c1-8-5-9(2)11(10(15)6-8)12-18-13(16)20-14(19-12)21-4-3-17-7-21/h3-7H,1-2H3,(H2,16,18,19,20)
InChIKeyQAPMQRHHMSDZKM-UHFFFAOYSA-N
XLogP2.06
TPSA82.51 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.30
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 4-(2-fluoro-4,6-dimethylphenyl)-6-imidazol-1-yl-1,3,5-triazin-2-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

4-imidazol-1-yl-6-(2,4,5-trifluorophenyl)-1,3,5-triazin-2-amine
CID 115503366
4-imidazol-1-yl-6-(5-methyl-3-pyridinyl)-1,3,5-triazin-2-amine
CID 115375454
4-(5-bromo-2-fluorophenyl)-6-imidazol-1-yl-1,3,5-triazin-2-amine
CID 79743243
1-[2-(2-imidazol-1-yl-4,6-dimethylphenyl)-3,5-dimethylphenyl]imidazole
CID 122388933
4-(2-fluoro-3-methoxyphenyl)-6-imidazol-1-yl-1,3,5-triazin-2-amine
CID 82792598
4-imidazol-1-yl-6-(3-methylphenyl)sulfanyl-1,3,5-triazin-2-amine
CID 80886142
4-(2,5-dimethylphenoxy)-6-imidazol-1-yl-1,3,5-triazin-2-amine
CID 80866768
4-imidazol-1-yl-6-(3-methoxypyrazin-2-yl)-1,3,5-triazin-2-amine
CID 104516651
2-N-(3,4-difluorophenyl)-6-imidazol-1-yl-1,3,5-triazine-2,4-diamine
CID 80738135
4-imidazol-1-yl-6-propan-2-ylsulfanyl-1,3,5-triazin-2-amine
CID 80886477
4-(4-chloro-3-methoxyphenyl)-6-imidazol-1-yl-1,3,5-triazin-2-amine
CID 79699581
6-imidazol-1-yl-4-N-methyl-4-N-(4-methylphenyl)-1,3,5-triazine-2,4-diamine
CID 80798257

Frequently Asked Questions

What is the IUPAC name of 4-(2-fluoro-4,6-dimethylphenyl)-6-imidazol-1-yl-1,3,5-triazin-2-amine?
The IUPAC name of 4-(2-fluoro-4,6-dimethylphenyl)-6-imidazol-1-yl-1,3,5-triazin-2-amine (CID 106882750) is 4-(2-fluoro-4,6-dimethylphenyl)-6-imidazol-1-yl-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-(2-fluoro-4,6-dimethylphenyl)-6-imidazol-1-yl-1,3,5-triazin-2-amine?
The canonical SMILES for 4-(2-fluoro-4,6-dimethylphenyl)-6-imidazol-1-yl-1,3,5-triazin-2-amine is Cc1cc(C)c(-c2nc(N)nc(-n3ccnc3)n2)c(F)c1.
What is the InChIKey of 4-(2-fluoro-4,6-dimethylphenyl)-6-imidazol-1-yl-1,3,5-triazin-2-amine?
The InChIKey is QAPMQRHHMSDZKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13FN6/c1-8-5-9(2)11(10(15)6-8)12-18-13(16)20-14(19-12)21-4-3-17-7-21/h3-7H,1-2H3,(H2,16,18,19,20).
What are the key properties of 4-(2-fluoro-4,6-dimethylphenyl)-6-imidazol-1-yl-1,3,5-triazin-2-amine?
4-(2-fluoro-4,6-dimethylphenyl)-6-imidazol-1-yl-1,3,5-triazin-2-amine has a molecular weight of 284.30 g/mol, XLogP of 2.06, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-fluoro-4,6-dimethylphenyl)-6-imidazol-1-yl-1,3,5-triazin-2-amine is sourced from PubChem (CID 106882750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).