7-bromo-1-methyl-5-[4-(trifluoromethoxy)phenyl]-4H-imidazo[4,5-c]pyridin-4-ol

C14H11BrF3N3O2 — CID 139390766

IUPAC7-bromo-1-methyl-5-[4-(trifluoromethoxy)phenyl]-4H-imidazo[4,5-c]pyridin-4-ol
SMILESCn1cnc2c1C(Br)=CN(c1ccc(OC(F)(F)F)cc1)C2O
InChIInChI=1S/C14H11BrF3N3O2/c1-20-7-19-11-12(20)10(15)6-21(13(11)22)8-2-4-9(5-3-8)23-14(16,17)18/h2-7,13,22H,1H3
InChIKeyBWWKXZGKUGLFEW-UHFFFAOYSA-N
MW390.16 g/mol
LogP3.52
Rot. Bonds2

About 7-bromo-1-methyl-5-[4-(trifluoromethoxy)phenyl]-4H-imidazo[4,5-c]pyridin-4-ol

7-bromo-1-methyl-5-[4-(trifluoromethoxy)phenyl]-4H-imidazo[4,5-c]pyridin-4-ol (PubChem CID 139390766) has the molecular formula C14H11BrF3N3O2 and a molecular weight of 390.16 g/mol. Its IUPAC name is 7-bromo-1-methyl-5-[4-(trifluoromethoxy)phenyl]-4H-imidazo[4,5-c]pyridin-4-ol.

Molecular Properties

Compound Name7-bromo-1-methyl-5-[4-(trifluoromethoxy)phenyl]-4H-imidazo[4,5-c]pyridin-4-ol
PubChem CID139390766
Molecular FormulaC14H11BrF3N3O2
Molecular Weight390.16 g/mol
Exact Mass389.00
IUPAC Name7-bromo-1-methyl-5-[4-(trifluoromethoxy)phenyl]-4H-imidazo[4,5-c]pyridin-4-ol
SMILESCn1cnc2c1C(Br)=CN(c1ccc(OC(F)(F)F)cc1)C2O
InChIInChI=1S/C14H11BrF3N3O2/c1-20-7-19-11-12(20)10(15)6-21(13(11)22)8-2-4-9(5-3-8)23-14(16,17)18/h2-7,13,22H,1H3
InChIKeyBWWKXZGKUGLFEW-UHFFFAOYSA-N
XLogP3.52
TPSA50.52 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.16
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-bromo-1-methyl-4-[4-(trifluoromethoxy)phenyl]benzimidazole
CID 168825423
1-methyl-5-[4-(trifluoromethoxy)phenyl]imidazole
CID 134354899
3,4-dimethyl-1-[4-(trifluoromethoxy)phenyl]pyrazole
CID 176921516
3-chloro-4-[4-(trifluoromethoxy)phenyl]-1,2,4-triazole
CID 63384165
5-bromo-N-pentan-3-yl-2-[4-(trifluoromethoxy)phenyl]-1,2,4-triazol-3-amine
CID 155586758
1-benzyl-4-(1-methylpyrazol-4-yl)-6-[4-(trifluoromethoxy)phenyl]-7H-pyrrolo[2,3-c]pyridin-7-ol
CID 155110800
5-bromo-N-methoxy-N-methyl-2-[4-(trifluoromethoxy)phenyl]-1,2,4-triazol-3-amine
CID 161172584
4-[4-[4-(trifluoromethoxy)phenyl]piperidin-1-yl]phenol
CID 70874455
[1-[4-(trifluoromethoxy)phenyl]-1,2,4-triazol-3-yl] 2,2,2-trifluoroacetate
CID 151572412
3-chloro-4-methyl-1-[4-(trifluoromethoxy)phenyl]pyrazole
CID 130223137
1-[4-(trifluoromethoxy)phenyl]-1,2,4-triazole-3-carbaldehyde
CID 126645592
1-[4-(trifluoromethoxy)phenyl]piperidin-3-ol
CID 71226421

Frequently Asked Questions

What is the IUPAC name of 7-bromo-1-methyl-5-[4-(trifluoromethoxy)phenyl]-4H-imidazo[4,5-c]pyridin-4-ol?
The IUPAC name of 7-bromo-1-methyl-5-[4-(trifluoromethoxy)phenyl]-4H-imidazo[4,5-c]pyridin-4-ol (CID 139390766) is 7-bromo-1-methyl-5-[4-(trifluoromethoxy)phenyl]-4H-imidazo[4,5-c]pyridin-4-ol.
What is the SMILES notation for 7-bromo-1-methyl-5-[4-(trifluoromethoxy)phenyl]-4H-imidazo[4,5-c]pyridin-4-ol?
The canonical SMILES for 7-bromo-1-methyl-5-[4-(trifluoromethoxy)phenyl]-4H-imidazo[4,5-c]pyridin-4-ol is Cn1cnc2c1C(Br)=CN(c1ccc(OC(F)(F)F)cc1)C2O.
What is the InChIKey of 7-bromo-1-methyl-5-[4-(trifluoromethoxy)phenyl]-4H-imidazo[4,5-c]pyridin-4-ol?
The InChIKey is BWWKXZGKUGLFEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11BrF3N3O2/c1-20-7-19-11-12(20)10(15)6-21(13(11)22)8-2-4-9(5-3-8)23-14(16,17)18/h2-7,13,22H,1H3.
What are the key properties of 7-bromo-1-methyl-5-[4-(trifluoromethoxy)phenyl]-4H-imidazo[4,5-c]pyridin-4-ol?
7-bromo-1-methyl-5-[4-(trifluoromethoxy)phenyl]-4H-imidazo[4,5-c]pyridin-4-ol has a molecular weight of 390.16 g/mol, XLogP of 3.52, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-bromo-1-methyl-5-[4-(trifluoromethoxy)phenyl]-4H-imidazo[4,5-c]pyridin-4-ol is sourced from PubChem (CID 139390766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).