6-[2-tert-butyl-5-(4-fluorophenyl)-1H-imidazol-4-yl]-1-(2,2-dimethylpropyl)imidazo[4,5-b]pyridin-2-amine

C24H29FN6 — CID 11464289

IUPAC6-[2-tert-butyl-5-(4-fluorophenyl)-1H-imidazol-4-yl]-1-(2,2-dimethylpropyl)imidazo[4,5-b]pyridin-2-amine
SMILESCC(C)(C)Cn1c(N)nc2ncc(-c3nc(C(C)(C)C)[nH]c3-c3ccc(F)cc3)cc21
InChIInChI=1S/C24H29FN6/c1-23(2,3)13-31-17-11-15(12-27-20(17)30-22(31)26)19-18(14-7-9-16(25)10-8-14)28-21(29-19)24(4,5)6/h7-12H,13H2,1-6H3,(H,28,29)(H2,26,27,30)
InChIKeyLODITBOOCLOMAM-UHFFFAOYSA-N
MW420.54 g/mol
LogP5.55
Rot. Bonds3

About 6-[2-tert-butyl-5-(4-fluorophenyl)-1H-imidazol-4-yl]-1-(2,2-dimethylpropyl)imidazo[4,5-b]pyridin-2-amine

6-[2-tert-butyl-5-(4-fluorophenyl)-1H-imidazol-4-yl]-1-(2,2-dimethylpropyl)imidazo[4,5-b]pyridin-2-amine (PubChem CID 11464289) has the molecular formula C24H29FN6 and a molecular weight of 420.54 g/mol. Its IUPAC name is 6-[2-tert-butyl-5-(4-fluorophenyl)-1H-imidazol-4-yl]-1-(2,2-dimethylpropyl)imidazo[4,5-b]pyridin-2-amine.

Molecular Properties

Compound Name6-[2-tert-butyl-5-(4-fluorophenyl)-1H-imidazol-4-yl]-1-(2,2-dimethylpropyl)imidazo[4,5-b]pyridin-2-amine
PubChem CID11464289
Molecular FormulaC24H29FN6
Molecular Weight420.54 g/mol
Exact Mass420.24
IUPAC Name6-[2-tert-butyl-5-(4-fluorophenyl)-1H-imidazol-4-yl]-1-(2,2-dimethylpropyl)imidazo[4,5-b]pyridin-2-amine
SMILESCC(C)(C)Cn1c(N)nc2ncc(-c3nc(C(C)(C)C)[nH]c3-c3ccc(F)cc3)cc21
InChIInChI=1S/C24H29FN6/c1-23(2,3)13-31-17-11-15(12-27-20(17)30-22(31)26)19-18(14-7-9-16(25)10-8-14)28-21(29-19)24(4,5)6/h7-12H,13H2,1-6H3,(H,28,29)(H2,26,27,30)
InChIKeyLODITBOOCLOMAM-UHFFFAOYSA-N
XLogP5.55
TPSA85.41 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500420.54
LogP ≤ 55.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 6-[2-tert-butyl-5-(4-fluorophenyl)-1H-imidazol-4-yl]-1-(2,2-dimethylpropyl)imidazo[4,5-b]pyridin-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

5-[2-tert-butyl-4-(4-fluorophenyl)-1H-imidazol-5-yl]-3-(2,2-dimethylpropyl)imidazo[4,5-b]pyridin-2-amine;dihydrochloride
CID 68870770
5-(2-tert-butyl-4-phenyl-1H-imidazol-5-yl)-3-(2,2-dimethylpropyl)imidazo[4,5-b]pyridin-2-amine
CID 87607413
5-(2-tert-butyl-5-pyridin-4-yl-1H-imidazol-4-yl)-3-methoxypyridin-2-amine
CID 59137482
[[5-[2-tert-butyl-4-(4-fluorophenyl)-1H-imidazol-5-yl]-3-(2,2-dimethylpropyl)imidazo[4,5-b]pyridin-2-yl]amino]methanesulfonic acid
CID 175061112
4-(2,2-dimethylpropyl)-3,5-bis(4-fluorophenyl)-1,2,4-triazole
CID 58390305
1-(2,2-dimethylbutyl)-6-fluorobenzimidazol-2-amine
CID 103462884
4-[4-(6-amino-5-methoxy-3-pyridinyl)-2-tert-butyl-1H-imidazol-5-yl]-N-[[4-(trifluoromethyl)phenyl]methyl]pyrimidin-2-amine
CID 59137504
5-(5-fluoro-1-propylbenzimidazol-2-yl)pyridin-2-amine
CID 63262376
4,5-bis(4-ethoxyphenyl)-2-(trifluoromethyl)-1H-imidazole
CID 154311787
2-tert-butyl-6-(4-fluoro-2-methylphenyl)-5-methyl-1H-pyrimidine-4-thione
CID 106514957
5-[5-(2-amino-4-pyridinyl)-2-(4-fluorophenyl)-1H-imidazol-4-yl]-3-methoxypyridin-2-amine
CID 70970698
2-tert-butyl-5-(4-methylsulfonylphenyl)-4-phenyl-1H-imidazole
CID 18463750

Frequently Asked Questions

What is the IUPAC name of 6-[2-tert-butyl-5-(4-fluorophenyl)-1H-imidazol-4-yl]-1-(2,2-dimethylpropyl)imidazo[4,5-b]pyridin-2-amine?
The IUPAC name of 6-[2-tert-butyl-5-(4-fluorophenyl)-1H-imidazol-4-yl]-1-(2,2-dimethylpropyl)imidazo[4,5-b]pyridin-2-amine (CID 11464289) is 6-[2-tert-butyl-5-(4-fluorophenyl)-1H-imidazol-4-yl]-1-(2,2-dimethylpropyl)imidazo[4,5-b]pyridin-2-amine.
What is the SMILES notation for 6-[2-tert-butyl-5-(4-fluorophenyl)-1H-imidazol-4-yl]-1-(2,2-dimethylpropyl)imidazo[4,5-b]pyridin-2-amine?
The canonical SMILES for 6-[2-tert-butyl-5-(4-fluorophenyl)-1H-imidazol-4-yl]-1-(2,2-dimethylpropyl)imidazo[4,5-b]pyridin-2-amine is CC(C)(C)Cn1c(N)nc2ncc(-c3nc(C(C)(C)C)[nH]c3-c3ccc(F)cc3)cc21.
What is the InChIKey of 6-[2-tert-butyl-5-(4-fluorophenyl)-1H-imidazol-4-yl]-1-(2,2-dimethylpropyl)imidazo[4,5-b]pyridin-2-amine?
The InChIKey is LODITBOOCLOMAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H29FN6/c1-23(2,3)13-31-17-11-15(12-27-20(17)30-22(31)26)19-18(14-7-9-16(25)10-8-14)28-21(29-19)24(4,5)6/h7-12H,13H2,1-6H3,(H,28,29)(H2,26,27,30).
What are the key properties of 6-[2-tert-butyl-5-(4-fluorophenyl)-1H-imidazol-4-yl]-1-(2,2-dimethylpropyl)imidazo[4,5-b]pyridin-2-amine?
6-[2-tert-butyl-5-(4-fluorophenyl)-1H-imidazol-4-yl]-1-(2,2-dimethylpropyl)imidazo[4,5-b]pyridin-2-amine has a molecular weight of 420.54 g/mol, XLogP of 5.55, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-tert-butyl-5-(4-fluorophenyl)-1H-imidazol-4-yl]-1-(2,2-dimethylpropyl)imidazo[4,5-b]pyridin-2-amine is sourced from PubChem (CID 11464289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).