N-methyl-2-(oxolan-3-ylmethoxy)-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]acetamide

C17H24F3N3O3 — CID 128966265

IUPACN-methyl-2-(oxolan-3-ylmethoxy)-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]acetamide
SMILESCN(CC1CCc2nc(C(F)(F)F)cn2C1)C(=O)COCC1CCOC1
InChIInChI=1S/C17H24F3N3O3/c1-22(16(24)11-26-10-13-4-5-25-9-13)6-12-2-3-15-21-14(17(18,19)20)8-23(15)7-12/h8,12-13H,2-7,9-11H2,1H3
InChIKeySSKFAXDDUQHONA-UHFFFAOYSA-N
MW375.39 g/mol
LogP1.98
Rot. Bonds6

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

N-methyl-2-(oxolan-3-ylmethoxy)-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]acetamide (PubChem CID 128966265) has the molecular formula C17H24F3N3O3 and a molecular weight of 375.39 g/mol. Its IUPAC name is N-methyl-2-(oxolan-3-ylmethoxy)-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]acetamide.

Molecular Properties

Compound NameN-methyl-2-(oxolan-3-ylmethoxy)-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]acetamide
PubChem CID128966265
Molecular FormulaC17H24F3N3O3
Molecular Weight375.39 g/mol
Exact Mass375.18
IUPAC NameN-methyl-2-(oxolan-3-ylmethoxy)-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]acetamide
SMILESCN(CC1CCc2nc(C(F)(F)F)cn2C1)C(=O)COCC1CCOC1
InChIInChI=1S/C17H24F3N3O3/c1-22(16(24)11-26-10-13-4-5-25-9-13)6-12-2-3-15-21-14(17(18,19)20)8-23(15)7-12/h8,12-13H,2-7,9-11H2,1H3
InChIKeySSKFAXDDUQHONA-UHFFFAOYSA-N
XLogP1.98
TPSA56.59 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.39
LogP ≤ 51.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(oxolan-3-ylmethoxy)-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]acetamide?
The IUPAC name of N-methyl-2-(oxolan-3-ylmethoxy)-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]acetamide (CID 128966265) is N-methyl-2-(oxolan-3-ylmethoxy)-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]acetamide.
What is the SMILES notation for N-methyl-2-(oxolan-3-ylmethoxy)-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]acetamide?
The canonical SMILES for N-methyl-2-(oxolan-3-ylmethoxy)-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]acetamide is CN(CC1CCc2nc(C(F)(F)F)cn2C1)C(=O)COCC1CCOC1.
What is the InChIKey of N-methyl-2-(oxolan-3-ylmethoxy)-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]acetamide?
The InChIKey is SSKFAXDDUQHONA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24F3N3O3/c1-22(16(24)11-26-10-13-4-5-25-9-13)6-12-2-3-15-21-14(17(18,19)20)8-23(15)7-12/h8,12-13H,2-7,9-11H2,1H3.
What are the key properties of N-methyl-2-(oxolan-3-ylmethoxy)-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]acetamide?
N-methyl-2-(oxolan-3-ylmethoxy)-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]acetamide has a molecular weight of 375.39 g/mol, XLogP of 1.98, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(oxolan-3-ylmethoxy)-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]acetamide is sourced from PubChem (CID 128966265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).