N-methyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1-[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methanamine

C15H19F3N4O — CID 129333192

IUPACN-methyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1-[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methanamine
SMILESCc1cnc(CN(C)C[C@@H]2CCc3nc(C(F)(F)F)cn3C2)o1
InChIInChI=1S/C15H19F3N4O/c1-10-5-19-14(23-10)9-21(2)6-11-3-4-13-20-12(15(16,17)18)8-22(13)7-11/h5,8,11H,3-4,6-7,9H2,1-2H3/t11-/m0/s1
InChIKeyFHRZFIQXDIBQEQ-NSHDSACASA-N
MW328.34 g/mol
LogP2.89
Rot. Bonds4

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

N-methyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1-[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methanamine (PubChem CID 129333192) has the molecular formula C15H19F3N4O and a molecular weight of 328.34 g/mol. Its IUPAC name is N-methyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1-[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methanamine.

Molecular Properties

Compound NameN-methyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1-[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methanamine
PubChem CID129333192
Molecular FormulaC15H19F3N4O
Molecular Weight328.34 g/mol
Exact Mass328.15
IUPAC NameN-methyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1-[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methanamine
SMILESCc1cnc(CN(C)C[C@@H]2CCc3nc(C(F)(F)F)cn3C2)o1
InChIInChI=1S/C15H19F3N4O/c1-10-5-19-14(23-10)9-21(2)6-11-3-4-13-20-12(15(16,17)18)8-22(13)7-11/h5,8,11H,3-4,6-7,9H2,1-2H3/t11-/m0/s1
InChIKeyFHRZFIQXDIBQEQ-NSHDSACASA-N
XLogP2.89
TPSA47.09 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.34
LogP ≤ 52.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze N-methyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1-[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methanamine with MolForge

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Related Compounds

2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)-4,5-dimethyl-1,3-oxazole
CID 86774834
N-methyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1-[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methanamine
CID 128965326
N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-N-methyl-1-[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methanamine
CID 128966555
4,5-Dimethyl-2-[[3-[1-methyl-4-(trifluoromethyl)imidazol-2-yl]piperidin-1-yl]methyl]-1,3-oxazole
CID 128978590
5-Methyl-2-[[3-[1-methyl-4-(trifluoromethyl)imidazol-2-yl]piperidin-1-yl]methyl]-1,3-oxazole
CID 128978799
N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-N-methyl-1-[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methanamine
CID 128998865
1-(4,5-Dimethyl-1,3-oxazol-2-yl)-3-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]urea
CID 129004435
4,5-dimethyl-2-[[3-[5-(trifluoromethyl)-1H-imidazol-2-yl]piperidin-1-yl]methyl]-1,3-oxazole
CID 129006534
N-methyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1-[(6R)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methanamine
CID 129333191
N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-N-methyl-1-[(6R)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methanamine
CID 129334175
N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-N-methyl-1-[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methanamine
CID 129334176
1-(4,5-dimethyl-1,3-oxazol-2-yl)-3-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]urea
CID 129340369

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1-[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methanamine?
The IUPAC name of N-methyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1-[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methanamine (CID 129333192) is N-methyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1-[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methanamine.
What is the SMILES notation for N-methyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1-[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methanamine?
The canonical SMILES for N-methyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1-[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methanamine is Cc1cnc(CN(C)C[C@@H]2CCc3nc(C(F)(F)F)cn3C2)o1.
What is the InChIKey of N-methyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1-[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methanamine?
The InChIKey is FHRZFIQXDIBQEQ-NSHDSACASA-N. The full InChI is InChI=1S/C15H19F3N4O/c1-10-5-19-14(23-10)9-21(2)6-11-3-4-13-20-12(15(16,17)18)8-22(13)7-11/h5,8,11H,3-4,6-7,9H2,1-2H3/t11-/m0/s1.
What are the key properties of N-methyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1-[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methanamine?
N-methyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1-[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methanamine has a molecular weight of 328.34 g/mol, XLogP of 2.89, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1-[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methanamine is sourced from PubChem (CID 129333192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).