N,2-dimethyl-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]pyrazole-3-carboxamide

C15H18F3N5O — CID 129001119

IUPACN,2-dimethyl-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]pyrazole-3-carboxamide
SMILESCN(CC1CCc2nc(C(F)(F)F)cn2C1)C(=O)c1ccnn1C
InChIInChI=1S/C15H18F3N5O/c1-21(14(24)11-5-6-19-22(11)2)7-10-3-4-13-20-12(15(16,17)18)9-23(13)8-10/h5-6,9-10H,3-4,7-8H2,1-2H3
InChIKeyWLWYWUOVVPZOID-UHFFFAOYSA-N
MW341.34 g/mol
LogP1.97
Rot. Bonds3

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

N,2-dimethyl-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]pyrazole-3-carboxamide (PubChem CID 129001119) has the molecular formula C15H18F3N5O and a molecular weight of 341.34 g/mol. Its IUPAC name is N,2-dimethyl-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]pyrazole-3-carboxamide.

Molecular Properties

Compound NameN,2-dimethyl-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]pyrazole-3-carboxamide
PubChem CID129001119
Molecular FormulaC15H18F3N5O
Molecular Weight341.34 g/mol
Exact Mass341.15
IUPAC NameN,2-dimethyl-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]pyrazole-3-carboxamide
SMILESCN(CC1CCc2nc(C(F)(F)F)cn2C1)C(=O)c1ccnn1C
InChIInChI=1S/C15H18F3N5O/c1-21(14(24)11-5-6-19-22(11)2)7-10-3-4-13-20-12(15(16,17)18)9-23(13)8-10/h5-6,9-10H,3-4,7-8H2,1-2H3
InChIKeyWLWYWUOVVPZOID-UHFFFAOYSA-N
XLogP1.97
TPSA55.95 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.34
LogP ≤ 51.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]pyrazole-3-carboxamide?
The IUPAC name of N,2-dimethyl-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]pyrazole-3-carboxamide (CID 129001119) is N,2-dimethyl-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]pyrazole-3-carboxamide.
What is the SMILES notation for N,2-dimethyl-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]pyrazole-3-carboxamide?
The canonical SMILES for N,2-dimethyl-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]pyrazole-3-carboxamide is CN(CC1CCc2nc(C(F)(F)F)cn2C1)C(=O)c1ccnn1C.
What is the InChIKey of N,2-dimethyl-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]pyrazole-3-carboxamide?
The InChIKey is WLWYWUOVVPZOID-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18F3N5O/c1-21(14(24)11-5-6-19-22(11)2)7-10-3-4-13-20-12(15(16,17)18)9-23(13)8-10/h5-6,9-10H,3-4,7-8H2,1-2H3.
What are the key properties of N,2-dimethyl-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]pyrazole-3-carboxamide?
N,2-dimethyl-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]pyrazole-3-carboxamide has a molecular weight of 341.34 g/mol, XLogP of 1.97, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]pyrazole-3-carboxamide is sourced from PubChem (CID 129001119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).