N,N-dimethyl-2-[3-methyl-2-oxo-6-[3-(trifluoromethyl)phenyl]imidazo[4,5-b]pyridin-1-yl]acetamide

C18H17F3N4O2 — CID 134490124

IUPACN,N-dimethyl-2-[3-methyl-2-oxo-6-[3-(trifluoromethyl)phenyl]imidazo[4,5-b]pyridin-1-yl]acetamide
SMILESCN(C)C(=O)Cn1c(=O)n(C)c2ncc(-c3cccc(C(F)(F)F)c3)cc21
InChIInChI=1S/C18H17F3N4O2/c1-23(2)15(26)10-25-14-8-12(9-22-16(14)24(3)17(25)27)11-5-4-6-13(7-11)18(19,20)21/h4-9H,10H2,1-3H3
InChIKeyCHUALODKFSBYCN-UHFFFAOYSA-N
MW378.35 g/mol
LogP2.51
Rot. Bonds3

About N,N-dimethyl-2-[3-methyl-2-oxo-6-[3-(trifluoromethyl)phenyl]imidazo[4,5-b]pyridin-1-yl]acetamide

N,N-dimethyl-2-[3-methyl-2-oxo-6-[3-(trifluoromethyl)phenyl]imidazo[4,5-b]pyridin-1-yl]acetamide (PubChem CID 134490124) has the molecular formula C18H17F3N4O2 and a molecular weight of 378.35 g/mol. Its IUPAC name is N,N-dimethyl-2-[3-methyl-2-oxo-6-[3-(trifluoromethyl)phenyl]imidazo[4,5-b]pyridin-1-yl]acetamide.

Molecular Properties

Compound NameN,N-dimethyl-2-[3-methyl-2-oxo-6-[3-(trifluoromethyl)phenyl]imidazo[4,5-b]pyridin-1-yl]acetamide
PubChem CID134490124
Molecular FormulaC18H17F3N4O2
Molecular Weight378.35 g/mol
Exact Mass378.13
IUPAC NameN,N-dimethyl-2-[3-methyl-2-oxo-6-[3-(trifluoromethyl)phenyl]imidazo[4,5-b]pyridin-1-yl]acetamide
SMILESCN(C)C(=O)Cn1c(=O)n(C)c2ncc(-c3cccc(C(F)(F)F)c3)cc21
InChIInChI=1S/C18H17F3N4O2/c1-23(2)15(26)10-25-14-8-12(9-22-16(14)24(3)17(25)27)11-5-4-6-13(7-11)18(19,20)21/h4-9H,10H2,1-3H3
InChIKeyCHUALODKFSBYCN-UHFFFAOYSA-N
XLogP2.51
TPSA60.13 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.35
LogP ≤ 52.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-[3-methyl-2-oxo-6-[3-(trifluoromethyl)phenyl]imidazo[4,5-b]pyridin-1-yl]acetamide?
The IUPAC name of N,N-dimethyl-2-[3-methyl-2-oxo-6-[3-(trifluoromethyl)phenyl]imidazo[4,5-b]pyridin-1-yl]acetamide (CID 134490124) is N,N-dimethyl-2-[3-methyl-2-oxo-6-[3-(trifluoromethyl)phenyl]imidazo[4,5-b]pyridin-1-yl]acetamide.
What is the SMILES notation for N,N-dimethyl-2-[3-methyl-2-oxo-6-[3-(trifluoromethyl)phenyl]imidazo[4,5-b]pyridin-1-yl]acetamide?
The canonical SMILES for N,N-dimethyl-2-[3-methyl-2-oxo-6-[3-(trifluoromethyl)phenyl]imidazo[4,5-b]pyridin-1-yl]acetamide is CN(C)C(=O)Cn1c(=O)n(C)c2ncc(-c3cccc(C(F)(F)F)c3)cc21.
What is the InChIKey of N,N-dimethyl-2-[3-methyl-2-oxo-6-[3-(trifluoromethyl)phenyl]imidazo[4,5-b]pyridin-1-yl]acetamide?
The InChIKey is CHUALODKFSBYCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17F3N4O2/c1-23(2)15(26)10-25-14-8-12(9-22-16(14)24(3)17(25)27)11-5-4-6-13(7-11)18(19,20)21/h4-9H,10H2,1-3H3.
What are the key properties of N,N-dimethyl-2-[3-methyl-2-oxo-6-[3-(trifluoromethyl)phenyl]imidazo[4,5-b]pyridin-1-yl]acetamide?
N,N-dimethyl-2-[3-methyl-2-oxo-6-[3-(trifluoromethyl)phenyl]imidazo[4,5-b]pyridin-1-yl]acetamide has a molecular weight of 378.35 g/mol, XLogP of 2.51, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-[3-methyl-2-oxo-6-[3-(trifluoromethyl)phenyl]imidazo[4,5-b]pyridin-1-yl]acetamide is sourced from PubChem (CID 134490124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).