2-tert-butyl-4-(3-fluoro-4-methoxyphenyl)imidazole-1,5-diamine

C14H19FN4O — CID 65096454

IUPAC2-tert-butyl-4-(3-fluoro-4-methoxyphenyl)imidazole-1,5-diamine
SMILESCOc1ccc(-c2nc(C(C)(C)C)n(N)c2N)cc1F
InChIInChI=1S/C14H19FN4O/c1-14(2,3)13-18-11(12(16)19(13)17)8-5-6-10(20-4)9(15)7-8/h5-7H,16-17H2,1-4H3
InChIKeySUTWWSOXXDONCZ-UHFFFAOYSA-N
MW278.33 g/mol
LogP2.29
Rot. Bonds2

About 2-tert-butyl-4-(3-fluoro-4-methoxyphenyl)imidazole-1,5-diamine

2-tert-butyl-4-(3-fluoro-4-methoxyphenyl)imidazole-1,5-diamine (PubChem CID 65096454) has the molecular formula C14H19FN4O and a molecular weight of 278.33 g/mol. Its IUPAC name is 2-tert-butyl-4-(3-fluoro-4-methoxyphenyl)imidazole-1,5-diamine.

Molecular Properties

Compound Name2-tert-butyl-4-(3-fluoro-4-methoxyphenyl)imidazole-1,5-diamine
PubChem CID65096454
Molecular FormulaC14H19FN4O
Molecular Weight278.33 g/mol
Exact Mass278.15
IUPAC Name2-tert-butyl-4-(3-fluoro-4-methoxyphenyl)imidazole-1,5-diamine
SMILESCOc1ccc(-c2nc(C(C)(C)C)n(N)c2N)cc1F
InChIInChI=1S/C14H19FN4O/c1-14(2,3)13-18-11(12(16)19(13)17)8-5-6-10(20-4)9(15)7-8/h5-7H,16-17H2,1-4H3
InChIKeySUTWWSOXXDONCZ-UHFFFAOYSA-N
XLogP2.29
TPSA79.09 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.33
LogP ≤ 52.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-tert-butyl-4-(3-fluoro-4-methoxyphenyl)imidazole-1,5-diamine 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

2-tert-butyl-3-ethyl-5-(3-fluoro-4-methoxyphenyl)imidazol-4-amine
CID 65096311
2-tert-butyl-4-(3,5-difluorophenyl)imidazole-1,5-diamine
CID 106531957
2-tert-butyl-4-(6-methoxy-3-pyridinyl)imidazole-1,5-diamine
CID 114938291
3-ethyl-5-(3-fluoro-4-methoxyphenyl)-2-methylimidazol-4-amine
CID 65096402
2-ethyl-5-(3-fluoro-4-methoxyphenyl)-3-methylimidazol-4-amine
CID 65096550
2-(3-fluoro-4-methoxyphenyl)-5-methylimidazo[1,2-a]pyridin-3-amine
CID 65101402
3-ethyl-5-(3-fluoro-4-methoxyphenyl)imidazol-4-amine
CID 65096261
4-(3,4-dimethoxyphenyl)-2-propan-2-ylimidazole-1,5-diamine
CID 62506121
2-tert-butyl-4-(3-cyclopropylphenyl)imidazole-1,5-diamine
CID 79980757
[3-amino-2-(3-fluoro-4-methoxyphenyl)imidazo[1,2-a]pyridin-8-yl]methanol
CID 82355992
3-(3-fluoro-4-methoxyphenyl)-5-methoxy-6-methylpyridin-2-amine
CID 157017577
2-tert-butyl-5-(4-chloro-3-fluorophenyl)-3-propan-2-ylimidazol-4-amine
CID 63470005

Frequently Asked Questions

What is the IUPAC name of 2-tert-butyl-4-(3-fluoro-4-methoxyphenyl)imidazole-1,5-diamine?
The IUPAC name of 2-tert-butyl-4-(3-fluoro-4-methoxyphenyl)imidazole-1,5-diamine (CID 65096454) is 2-tert-butyl-4-(3-fluoro-4-methoxyphenyl)imidazole-1,5-diamine.
What is the SMILES notation for 2-tert-butyl-4-(3-fluoro-4-methoxyphenyl)imidazole-1,5-diamine?
The canonical SMILES for 2-tert-butyl-4-(3-fluoro-4-methoxyphenyl)imidazole-1,5-diamine is COc1ccc(-c2nc(C(C)(C)C)n(N)c2N)cc1F.
What is the InChIKey of 2-tert-butyl-4-(3-fluoro-4-methoxyphenyl)imidazole-1,5-diamine?
The InChIKey is SUTWWSOXXDONCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19FN4O/c1-14(2,3)13-18-11(12(16)19(13)17)8-5-6-10(20-4)9(15)7-8/h5-7H,16-17H2,1-4H3.
What are the key properties of 2-tert-butyl-4-(3-fluoro-4-methoxyphenyl)imidazole-1,5-diamine?
2-tert-butyl-4-(3-fluoro-4-methoxyphenyl)imidazole-1,5-diamine has a molecular weight of 278.33 g/mol, XLogP of 2.29, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-tert-butyl-4-(3-fluoro-4-methoxyphenyl)imidazole-1,5-diamine is sourced from PubChem (CID 65096454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).