N-[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]cyclohexanecarboxamide

C15H20F3N3O — CID 155902520

IUPACN-[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]cyclohexanecarboxamide
SMILESO=C(NC1CCc2ncc(C(F)(F)F)n2C1)C1CCCCC1
InChIInChI=1S/C15H20F3N3O/c16-15(17,18)12-8-19-13-7-6-11(9-21(12)13)20-14(22)10-4-2-1-3-5-10/h8,10-11H,1-7,9H2,(H,20,22)
InChIKeyXHNVNTHNFINMJN-UHFFFAOYSA-N
MW315.34 g/mol
LogP2.91
Rot. Bonds2

About N-[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]cyclohexanecarboxamide

N-[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]cyclohexanecarboxamide (PubChem CID 155902520) has the molecular formula C15H20F3N3O and a molecular weight of 315.34 g/mol. Its IUPAC name is N-[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]cyclohexanecarboxamide.

Molecular Properties

Compound NameN-[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]cyclohexanecarboxamide
PubChem CID155902520
Molecular FormulaC15H20F3N3O
Molecular Weight315.34 g/mol
Exact Mass315.16
IUPAC NameN-[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]cyclohexanecarboxamide
SMILESO=C(NC1CCc2ncc(C(F)(F)F)n2C1)C1CCCCC1
InChIInChI=1S/C15H20F3N3O/c16-15(17,18)12-8-19-13-7-6-11(9-21(12)13)20-14(22)10-4-2-1-3-5-10/h8,10-11H,1-7,9H2,(H,20,22)
InChIKeyXHNVNTHNFINMJN-UHFFFAOYSA-N
XLogP2.91
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.34
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]cyclohexanecarboxamide?
The IUPAC name of N-[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]cyclohexanecarboxamide (CID 155902520) is N-[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]cyclohexanecarboxamide.
What is the SMILES notation for N-[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]cyclohexanecarboxamide?
The canonical SMILES for N-[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]cyclohexanecarboxamide is O=C(NC1CCc2ncc(C(F)(F)F)n2C1)C1CCCCC1.
What is the InChIKey of N-[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]cyclohexanecarboxamide?
The InChIKey is XHNVNTHNFINMJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20F3N3O/c16-15(17,18)12-8-19-13-7-6-11(9-21(12)13)20-14(22)10-4-2-1-3-5-10/h8,10-11H,1-7,9H2,(H,20,22).
What are the key properties of N-[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]cyclohexanecarboxamide?
N-[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]cyclohexanecarboxamide has a molecular weight of 315.34 g/mol, XLogP of 2.91, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]cyclohexanecarboxamide is sourced from PubChem (CID 155902520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).