6-methyl-2-oxo-N-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1H-pyrimidine-4-carboxamide

C15H16F3N5O2 — CID 129329620

IUPAC6-methyl-2-oxo-N-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1H-pyrimidine-4-carboxamide
SMILESCc1cc(C(=O)NC[C@@H]2CCc3nc(C(F)(F)F)cn3C2)nc(=O)[nH]1
InChIInChI=1S/C15H16F3N5O2/c1-8-4-10(21-14(25)20-8)13(24)19-5-9-2-3-12-22-11(15(16,17)18)7-23(12)6-9/h4,7,9H,2-3,5-6H2,1H3,(H,19,24)(H,20,21,25)/t9-/m0/s1
InChIKeyGAUBHZBOFXQEEV-VIFPVBQESA-N
MW355.32 g/mol
LogP1.29
Rot. Bonds3

About 6-methyl-2-oxo-N-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1H-pyrimidine-4-carboxamide

6-methyl-2-oxo-N-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1H-pyrimidine-4-carboxamide (PubChem CID 129329620) has the molecular formula C15H16F3N5O2 and a molecular weight of 355.32 g/mol. Its IUPAC name is 6-methyl-2-oxo-N-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1H-pyrimidine-4-carboxamide.

Molecular Properties

Compound Name6-methyl-2-oxo-N-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1H-pyrimidine-4-carboxamide
PubChem CID129329620
Molecular FormulaC15H16F3N5O2
Molecular Weight355.32 g/mol
Exact Mass355.13
IUPAC Name6-methyl-2-oxo-N-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1H-pyrimidine-4-carboxamide
SMILESCc1cc(C(=O)NC[C@@H]2CCc3nc(C(F)(F)F)cn3C2)nc(=O)[nH]1
InChIInChI=1S/C15H16F3N5O2/c1-8-4-10(21-14(25)20-8)13(24)19-5-9-2-3-12-22-11(15(16,17)18)7-23(12)6-9/h4,7,9H,2-3,5-6H2,1H3,(H,19,24)(H,20,21,25)/t9-/m0/s1
InChIKeyGAUBHZBOFXQEEV-VIFPVBQESA-N
XLogP1.29
TPSA92.67 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.32
LogP ≤ 51.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 6-methyl-2-oxo-N-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1H-pyrimidine-4-carboxamide with MolForge

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Related Compounds

1-methyl-6-oxo-N-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]pyridazine-3-carboxamide
CID 129330547
2-methyl-N-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1H-pyrrole-3-carboxamide
CID 129329247
3,5-dimethyl-N-[[(6R)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1,2-oxazole-4-carboxamide
CID 129329002
5-ethyl-4-methyl-N-[[(6R)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]furan-2-carboxamide
CID 129328959
2,4-dimethyl-N-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]pyrimidine-5-carboxamide
CID 129329094
5-ethyl-3-methyl-N-[[(6R)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1,2-oxazole-4-carboxamide
CID 129341502
6-methyl-N-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-3,4-dihydro-2H-pyran-5-carboxamide
CID 129339897
2-oxo-N-[[(6R)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1H-pyridine-3-carboxamide
CID 129332825
5-cyano-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]pyridine-2-carboxamide
CID 129002375
2-(1-methylpyrazol-4-yl)-N-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]acetamide
CID 124737660
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
5-propyl-N-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1H-pyrazole-4-carboxamide
CID 129006376

Frequently Asked Questions

What is the IUPAC name of 6-methyl-2-oxo-N-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1H-pyrimidine-4-carboxamide?
The IUPAC name of 6-methyl-2-oxo-N-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1H-pyrimidine-4-carboxamide (CID 129329620) is 6-methyl-2-oxo-N-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1H-pyrimidine-4-carboxamide.
What is the SMILES notation for 6-methyl-2-oxo-N-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1H-pyrimidine-4-carboxamide?
The canonical SMILES for 6-methyl-2-oxo-N-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1H-pyrimidine-4-carboxamide is Cc1cc(C(=O)NC[C@@H]2CCc3nc(C(F)(F)F)cn3C2)nc(=O)[nH]1.
What is the InChIKey of 6-methyl-2-oxo-N-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1H-pyrimidine-4-carboxamide?
The InChIKey is GAUBHZBOFXQEEV-VIFPVBQESA-N. The full InChI is InChI=1S/C15H16F3N5O2/c1-8-4-10(21-14(25)20-8)13(24)19-5-9-2-3-12-22-11(15(16,17)18)7-23(12)6-9/h4,7,9H,2-3,5-6H2,1H3,(H,19,24)(H,20,21,25)/t9-/m0/s1.
What are the key properties of 6-methyl-2-oxo-N-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1H-pyrimidine-4-carboxamide?
6-methyl-2-oxo-N-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1H-pyrimidine-4-carboxamide has a molecular weight of 355.32 g/mol, XLogP of 1.29, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-2-oxo-N-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1H-pyrimidine-4-carboxamide is sourced from PubChem (CID 129329620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).