N-[[6-(trifluoromethyl)-3-[4-(trifluoromethyl)phenyl]imidazo[1,5-a]pyridin-1-yl]methyl]acetamide

C18H13F6N3O — CID 172515070

IUPACN-[[6-(trifluoromethyl)-3-[4-(trifluoromethyl)phenyl]imidazo[1,5-a]pyridin-1-yl]methyl]acetamide
SMILESCC(=O)NCc1nc(-c2ccc(C(F)(F)F)cc2)n2cc(C(F)(F)F)ccc12
InChIInChI=1S/C18H13F6N3O/c1-10(28)25-8-14-15-7-6-13(18(22,23)24)9-27(15)16(26-14)11-2-4-12(5-3-11)17(19,20)21/h2-7,9H,8H2,1H3,(H,25,28)
InChIKeyIZDLNPBSMNGAQV-UHFFFAOYSA-N
MW401.31 g/mol
LogP4.68
Rot. Bonds3

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

N-[[6-(trifluoromethyl)-3-[4-(trifluoromethyl)phenyl]imidazo[1,5-a]pyridin-1-yl]methyl]acetamide (PubChem CID 172515070) has the molecular formula C18H13F6N3O and a molecular weight of 401.31 g/mol. Its IUPAC name is N-[[6-(trifluoromethyl)-3-[4-(trifluoromethyl)phenyl]imidazo[1,5-a]pyridin-1-yl]methyl]acetamide.

Molecular Properties

Compound NameN-[[6-(trifluoromethyl)-3-[4-(trifluoromethyl)phenyl]imidazo[1,5-a]pyridin-1-yl]methyl]acetamide
PubChem CID172515070
Molecular FormulaC18H13F6N3O
Molecular Weight401.31 g/mol
Exact Mass401.10
IUPAC NameN-[[6-(trifluoromethyl)-3-[4-(trifluoromethyl)phenyl]imidazo[1,5-a]pyridin-1-yl]methyl]acetamide
SMILESCC(=O)NCc1nc(-c2ccc(C(F)(F)F)cc2)n2cc(C(F)(F)F)ccc12
InChIInChI=1S/C18H13F6N3O/c1-10(28)25-8-14-15-7-6-13(18(22,23)24)9-27(15)16(26-14)11-2-4-12(5-3-11)17(19,20)21/h2-7,9H,8H2,1H3,(H,25,28)
InChIKeyIZDLNPBSMNGAQV-UHFFFAOYSA-N
XLogP4.68
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500401.31
LogP ≤ 54.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[[6-(trifluoromethyl)-3-[4-(trifluoromethyl)phenyl]imidazo[1,5-a]pyridin-1-yl]methyl]acetamide with MolForge

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Related Compounds

1-[3-methyl-6-(trifluoromethyl)imidazo[1,5-a]pyridin-1-yl]ethanone
CID 170088316
ethane;N-[[4-(trifluoromethyl)phenyl]methyl]acetamide
CID 144998983
4-bromo-1-methyl-2-[4-(trifluoromethyl)phenyl]imidazole
CID 172992944
2-methylpyridine;N-[[4-(trifluoromethyl)phenyl]methyl]acetamide
CID 162170581
2-acetamido-N-[[4-(trifluoromethyl)phenyl]methyl]acetamide
CID 143901871
N-[[1-amino-3-(trifluoromethyl)imidazo[1,5-a]pyridin-6-yl]methyl]acetamide
CID 145222271
2-acetamido-N-[2-oxo-2-[[4-(trifluoromethyl)phenyl]methylamino]ethyl]acetamide
CID 60559844
methyl 3-methyl-6-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxylate
CID 46941700
6-ethyl-2-methyl-N-[[4-[4-(trifluoromethyl)phenyl]phenyl]methyl]imidazo[2,1-b][1,3]thiazole-5-carboxamide
CID 118264341
1-[2-(4-fluorophenyl)-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-N-methylmethanamine;2,2,2-trifluoroacetic acid
CID 167889452
2,6-dimethyl-N-[[4-[4-(trifluoromethyl)phenyl]phenyl]methyl]imidazo[2,1-b][1,3]thiazole-5-carboxamide
CID 118267882
N-[4-(trifluoromethyl)phenoxy]acetamide
CID 162546353

Frequently Asked Questions

What is the IUPAC name of N-[[6-(trifluoromethyl)-3-[4-(trifluoromethyl)phenyl]imidazo[1,5-a]pyridin-1-yl]methyl]acetamide?
The IUPAC name of N-[[6-(trifluoromethyl)-3-[4-(trifluoromethyl)phenyl]imidazo[1,5-a]pyridin-1-yl]methyl]acetamide (CID 172515070) is N-[[6-(trifluoromethyl)-3-[4-(trifluoromethyl)phenyl]imidazo[1,5-a]pyridin-1-yl]methyl]acetamide.
What is the SMILES notation for N-[[6-(trifluoromethyl)-3-[4-(trifluoromethyl)phenyl]imidazo[1,5-a]pyridin-1-yl]methyl]acetamide?
The canonical SMILES for N-[[6-(trifluoromethyl)-3-[4-(trifluoromethyl)phenyl]imidazo[1,5-a]pyridin-1-yl]methyl]acetamide is CC(=O)NCc1nc(-c2ccc(C(F)(F)F)cc2)n2cc(C(F)(F)F)ccc12.
What is the InChIKey of N-[[6-(trifluoromethyl)-3-[4-(trifluoromethyl)phenyl]imidazo[1,5-a]pyridin-1-yl]methyl]acetamide?
The InChIKey is IZDLNPBSMNGAQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13F6N3O/c1-10(28)25-8-14-15-7-6-13(18(22,23)24)9-27(15)16(26-14)11-2-4-12(5-3-11)17(19,20)21/h2-7,9H,8H2,1H3,(H,25,28).
What are the key properties of N-[[6-(trifluoromethyl)-3-[4-(trifluoromethyl)phenyl]imidazo[1,5-a]pyridin-1-yl]methyl]acetamide?
N-[[6-(trifluoromethyl)-3-[4-(trifluoromethyl)phenyl]imidazo[1,5-a]pyridin-1-yl]methyl]acetamide has a molecular weight of 401.31 g/mol, XLogP of 4.68, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[6-(trifluoromethyl)-3-[4-(trifluoromethyl)phenyl]imidazo[1,5-a]pyridin-1-yl]methyl]acetamide is sourced from PubChem (CID 172515070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).