N-(2-propan-2-ylcyclopentyl)-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide

C17H24F3N3O — CID 154852741

IUPACN-(2-propan-2-ylcyclopentyl)-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide
SMILESCC(C)C1CCCC1NC(=O)c1nc(C(F)(F)F)n2c1CCCC2
InChIInChI=1S/C17H24F3N3O/c1-10(2)11-6-5-7-12(11)21-15(24)14-13-8-3-4-9-23(13)16(22-14)17(18,19)20/h10-12H,3-9H2,1-2H3,(H,21,24)
InChIKeyCODIQCVZJIXADL-UHFFFAOYSA-N
MW343.39 g/mol
LogP3.79
Rot. Bonds3

About N-(2-propan-2-ylcyclopentyl)-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide

N-(2-propan-2-ylcyclopentyl)-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide (PubChem CID 154852741) has the molecular formula C17H24F3N3O and a molecular weight of 343.39 g/mol. Its IUPAC name is N-(2-propan-2-ylcyclopentyl)-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide.

Molecular Properties

Compound NameN-(2-propan-2-ylcyclopentyl)-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide
PubChem CID154852741
Molecular FormulaC17H24F3N3O
Molecular Weight343.39 g/mol
Exact Mass343.19
IUPAC NameN-(2-propan-2-ylcyclopentyl)-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide
SMILESCC(C)C1CCCC1NC(=O)c1nc(C(F)(F)F)n2c1CCCC2
InChIInChI=1S/C17H24F3N3O/c1-10(2)11-6-5-7-12(11)21-15(24)14-13-8-3-4-9-23(13)16(22-14)17(18,19)20/h10-12H,3-9H2,1-2H3,(H,21,24)
InChIKeyCODIQCVZJIXADL-UHFFFAOYSA-N
XLogP3.79
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.39
LogP ≤ 53.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-propan-2-ylcyclopentyl)-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide?
The IUPAC name of N-(2-propan-2-ylcyclopentyl)-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide (CID 154852741) is N-(2-propan-2-ylcyclopentyl)-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide.
What is the SMILES notation for N-(2-propan-2-ylcyclopentyl)-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide?
The canonical SMILES for N-(2-propan-2-ylcyclopentyl)-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide is CC(C)C1CCCC1NC(=O)c1nc(C(F)(F)F)n2c1CCCC2.
What is the InChIKey of N-(2-propan-2-ylcyclopentyl)-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide?
The InChIKey is CODIQCVZJIXADL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24F3N3O/c1-10(2)11-6-5-7-12(11)21-15(24)14-13-8-3-4-9-23(13)16(22-14)17(18,19)20/h10-12H,3-9H2,1-2H3,(H,21,24).
What are the key properties of N-(2-propan-2-ylcyclopentyl)-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide?
N-(2-propan-2-ylcyclopentyl)-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide has a molecular weight of 343.39 g/mol, XLogP of 3.79, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-propan-2-ylcyclopentyl)-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxamide is sourced from PubChem (CID 154852741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).