N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclohexyl]-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide

C18H22F3N5O2 — CID 75472728

IUPACN-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclohexyl]-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide
SMILESCc1nc(C2(NC(=O)C3CCn4c(cnc4C(F)(F)F)C3)CCCCC2)no1
InChIInChI=1S/C18H22F3N5O2/c1-11-23-15(25-28-11)17(6-3-2-4-7-17)24-14(27)12-5-8-26-13(9-12)10-22-16(26)18(19,20)21/h10,12H,2-9H2,1H3,(H,24,27)
InChIKeyDEDDKAMFYJZLTK-UHFFFAOYSA-N
MW397.40 g/mol
LogP3.13
Rot. Bonds3

About N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclohexyl]-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide

N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclohexyl]-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide (PubChem CID 75472728) has the molecular formula C18H22F3N5O2 and a molecular weight of 397.40 g/mol. Its IUPAC name is N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclohexyl]-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide.

Molecular Properties

Compound NameN-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclohexyl]-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide
PubChem CID75472728
Molecular FormulaC18H22F3N5O2
Molecular Weight397.40 g/mol
Exact Mass397.17
IUPAC NameN-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclohexyl]-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide
SMILESCc1nc(C2(NC(=O)C3CCn4c(cnc4C(F)(F)F)C3)CCCCC2)no1
InChIInChI=1S/C18H22F3N5O2/c1-11-23-15(25-28-11)17(6-3-2-4-7-17)24-14(27)12-5-8-26-13(9-12)10-22-16(26)18(19,20)21/h10,12H,2-9H2,1H3,(H,24,27)
InChIKeyDEDDKAMFYJZLTK-UHFFFAOYSA-N
XLogP3.13
TPSA85.84 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500397.40
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclohexyl]-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclohexyl]-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide?
The IUPAC name of N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclohexyl]-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide (CID 75472728) is N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclohexyl]-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide.
What is the SMILES notation for N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclohexyl]-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide?
The canonical SMILES for N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclohexyl]-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide is Cc1nc(C2(NC(=O)C3CCn4c(cnc4C(F)(F)F)C3)CCCCC2)no1.
What is the InChIKey of N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclohexyl]-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide?
The InChIKey is DEDDKAMFYJZLTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22F3N5O2/c1-11-23-15(25-28-11)17(6-3-2-4-7-17)24-14(27)12-5-8-26-13(9-12)10-22-16(26)18(19,20)21/h10,12H,2-9H2,1H3,(H,24,27).
What are the key properties of N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclohexyl]-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide?
N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclohexyl]-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide has a molecular weight of 397.40 g/mol, XLogP of 3.13, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclohexyl]-3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide is sourced from PubChem (CID 75472728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).