2,3-dimethyl-N-[[1-(2,2,2-trifluoroethyl)piperidin-4-yl]methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxamide

C17H26F3N5O — CID 154742684

IUPAC2,3-dimethyl-N-[[1-(2,2,2-trifluoroethyl)piperidin-4-yl]methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxamide
SMILESCc1nc2n(c1C)CCN(C(=O)NCC1CCN(CC(F)(F)F)CC1)C2
InChIInChI=1S/C17H26F3N5O/c1-12-13(2)25-8-7-24(10-15(25)22-12)16(26)21-9-14-3-5-23(6-4-14)11-17(18,19)20/h14H,3-11H2,1-2H3,(H,21,26)
InChIKeyMYDOYUSHTOYXQP-UHFFFAOYSA-N
MW373.42 g/mol
LogP2.30
Rot. Bonds3

About 2,3-dimethyl-N-[[1-(2,2,2-trifluoroethyl)piperidin-4-yl]methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxamide

2,3-dimethyl-N-[[1-(2,2,2-trifluoroethyl)piperidin-4-yl]methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxamide (PubChem CID 154742684) has the molecular formula C17H26F3N5O and a molecular weight of 373.42 g/mol. Its IUPAC name is 2,3-dimethyl-N-[[1-(2,2,2-trifluoroethyl)piperidin-4-yl]methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxamide.

Molecular Properties

Compound Name2,3-dimethyl-N-[[1-(2,2,2-trifluoroethyl)piperidin-4-yl]methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxamide
PubChem CID154742684
Molecular FormulaC17H26F3N5O
Molecular Weight373.42 g/mol
Exact Mass373.21
IUPAC Name2,3-dimethyl-N-[[1-(2,2,2-trifluoroethyl)piperidin-4-yl]methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxamide
SMILESCc1nc2n(c1C)CCN(C(=O)NCC1CCN(CC(F)(F)F)CC1)C2
InChIInChI=1S/C17H26F3N5O/c1-12-13(2)25-8-7-24(10-15(25)22-12)16(26)21-9-14-3-5-23(6-4-14)11-17(18,19)20/h14H,3-11H2,1-2H3,(H,21,26)
InChIKeyMYDOYUSHTOYXQP-UHFFFAOYSA-N
XLogP2.30
TPSA53.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.42
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2,3-dimethyl-N-[[1-(2,2,2-trifluoroethyl)piperidin-4-yl]methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxamide with MolForge

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Related Compounds

7-ethyl-3-methyl-N-(2-methylpropyl)spiro[5,6-dihydroimidazo[1,2-a]pyrazine-8,4'-piperidine]-1'-carboxamide
CID 97523269
2-methyl-1-[(3S)-3-[(1,4,5-trimethylimidazol-2-yl)methylamino]piperidin-1-yl]propan-1-one
CID 164633411
3-(3,3-difluorocyclobutyl)-1-iodo-N-methyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carboxamide
CID 139530379
3-(4,4-difluorocyclohexyl)-1-iodo-N-methyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carboxamide
CID 139530410
3-(3,3-difluorocyclobutyl)-N,1-dimethyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carboxamide
CID 139543510
3-(4,4-difluorocyclohexyl)-N,1-dimethyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carboxamide
CID 139556316
1-acetyl-N-[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazin-1-yl]piperidine-4-carboxamide;hydrochloride
CID 141290532
N-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-1-(2,2,2-trifluoroethyl)piperidine-4-carboxamide
CID 72149671
2,3-Dimethyl-6-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-amine
CID 83966209
N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-1-(2,2,2-trifluoroethyl)piperidine-4-carboxamide
CID 95766027
N-[(6R)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-1-(2,2,2-trifluoroethyl)piperidine-4-carboxamide
CID 95766028
3-Ethyl-4-[[2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-2-one
CID 126821017

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyl-N-[[1-(2,2,2-trifluoroethyl)piperidin-4-yl]methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxamide?
The IUPAC name of 2,3-dimethyl-N-[[1-(2,2,2-trifluoroethyl)piperidin-4-yl]methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxamide (CID 154742684) is 2,3-dimethyl-N-[[1-(2,2,2-trifluoroethyl)piperidin-4-yl]methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxamide.
What is the SMILES notation for 2,3-dimethyl-N-[[1-(2,2,2-trifluoroethyl)piperidin-4-yl]methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxamide?
The canonical SMILES for 2,3-dimethyl-N-[[1-(2,2,2-trifluoroethyl)piperidin-4-yl]methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxamide is Cc1nc2n(c1C)CCN(C(=O)NCC1CCN(CC(F)(F)F)CC1)C2.
What is the InChIKey of 2,3-dimethyl-N-[[1-(2,2,2-trifluoroethyl)piperidin-4-yl]methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxamide?
The InChIKey is MYDOYUSHTOYXQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26F3N5O/c1-12-13(2)25-8-7-24(10-15(25)22-12)16(26)21-9-14-3-5-23(6-4-14)11-17(18,19)20/h14H,3-11H2,1-2H3,(H,21,26).
What are the key properties of 2,3-dimethyl-N-[[1-(2,2,2-trifluoroethyl)piperidin-4-yl]methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxamide?
2,3-dimethyl-N-[[1-(2,2,2-trifluoroethyl)piperidin-4-yl]methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxamide has a molecular weight of 373.42 g/mol, XLogP of 2.30, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-N-[[1-(2,2,2-trifluoroethyl)piperidin-4-yl]methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxamide is sourced from PubChem (CID 154742684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).