2-[methyl-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]amino]-N-(oxan-4-yl)acetamide

C17H25F3N4O2 — CID 129338575

IUPAC2-[methyl-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]amino]-N-(oxan-4-yl)acetamide
SMILESCN(CC(=O)NC1CCOCC1)C[C@@H]1CCc2nc(C(F)(F)F)cn2C1
InChIInChI=1S/C17H25F3N4O2/c1-23(11-16(25)21-13-4-6-26-7-5-13)8-12-2-3-15-22-14(17(18,19)20)10-24(15)9-12/h10,12-13H,2-9,11H2,1H3,(H,21,25)/t12-/m0/s1
InChIKeyNHDLXYJWROBFLW-LBPRGKRZSA-N
MW374.41 g/mol
LogP1.69
Rot. Bonds5

About 2-[methyl-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]amino]-N-(oxan-4-yl)acetamide

2-[methyl-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]amino]-N-(oxan-4-yl)acetamide (PubChem CID 129338575) has the molecular formula C17H25F3N4O2 and a molecular weight of 374.41 g/mol. Its IUPAC name is 2-[methyl-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]amino]-N-(oxan-4-yl)acetamide.

Molecular Properties

Compound Name2-[methyl-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]amino]-N-(oxan-4-yl)acetamide
PubChem CID129338575
Molecular FormulaC17H25F3N4O2
Molecular Weight374.41 g/mol
Exact Mass374.19
IUPAC Name2-[methyl-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]amino]-N-(oxan-4-yl)acetamide
SMILESCN(CC(=O)NC1CCOCC1)C[C@@H]1CCc2nc(C(F)(F)F)cn2C1
InChIInChI=1S/C17H25F3N4O2/c1-23(11-16(25)21-13-4-6-26-7-5-13)8-12-2-3-15-22-14(17(18,19)20)10-24(15)9-12/h10,12-13H,2-9,11H2,1H3,(H,21,25)/t12-/m0/s1
InChIKeyNHDLXYJWROBFLW-LBPRGKRZSA-N
XLogP1.69
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.41
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-[methyl-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]amino]-N-(oxan-4-yl)acetamide with MolForge

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Related Compounds

1-methyl-3-(oxan-4-yl)-1-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]urea
CID 128998409
2-[methyl-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]amino]-N-(1,3,4-thiadiazol-2-yl)acetamide
CID 129338421
1-methyl-3-[[(2R)-oxolan-2-yl]methyl]-1-[[(6R)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]urea
CID 129330219
1-methyl-3-(oxan-2-ylmethyl)-1-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]urea
CID 128998483
(3S)-3-[2-[methyl-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]amino]ethyl]oxolan-2-one
CID 129330736
N-[2-[methyl-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]amino]ethyl]ethanesulfonamide
CID 128966881
N,2-dimethyl-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]pyrazole-3-carboxamide
CID 129001119
(3S)-N-[[(6R)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]oxolan-3-amine
CID 129335524
2-N-methyl-2-N-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]furan-2,5-dicarboxamide
CID 129333834
1-methyl-3-[(1S)-1-[(2S)-oxolan-2-yl]ethyl]-1-[[(6R)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]urea
CID 129338807
N-methyl-5-propan-2-yl-N-[[(6R)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1,2-oxazole-3-carboxamide
CID 129332582
N,4-dimethyl-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]morpholine-2-carboxamide
CID 128966473

Frequently Asked Questions

What is the IUPAC name of 2-[methyl-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]amino]-N-(oxan-4-yl)acetamide?
The IUPAC name of 2-[methyl-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]amino]-N-(oxan-4-yl)acetamide (CID 129338575) is 2-[methyl-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]amino]-N-(oxan-4-yl)acetamide.
What is the SMILES notation for 2-[methyl-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]amino]-N-(oxan-4-yl)acetamide?
The canonical SMILES for 2-[methyl-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]amino]-N-(oxan-4-yl)acetamide is CN(CC(=O)NC1CCOCC1)C[C@@H]1CCc2nc(C(F)(F)F)cn2C1.
What is the InChIKey of 2-[methyl-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]amino]-N-(oxan-4-yl)acetamide?
The InChIKey is NHDLXYJWROBFLW-LBPRGKRZSA-N. The full InChI is InChI=1S/C17H25F3N4O2/c1-23(11-16(25)21-13-4-6-26-7-5-13)8-12-2-3-15-22-14(17(18,19)20)10-24(15)9-12/h10,12-13H,2-9,11H2,1H3,(H,21,25)/t12-/m0/s1.
What are the key properties of 2-[methyl-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]amino]-N-(oxan-4-yl)acetamide?
2-[methyl-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]amino]-N-(oxan-4-yl)acetamide has a molecular weight of 374.41 g/mol, XLogP of 1.69, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methyl-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]amino]-N-(oxan-4-yl)acetamide is sourced from PubChem (CID 129338575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).