N,N-dimethyl-2-[(8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-yl)methoxy]acetamide;2,2,2-trifluoroacetic acid

C14H21F3N4O4 — CID 155828587

IUPACN,N-dimethyl-2-[(8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-yl)methoxy]acetamide;2,2,2-trifluoroacetic acid
SMILESCC1NCCn2c(COCC(=O)N(C)C)cnc21.O=C(O)C(F)(F)F
InChIInChI=1S/C12H20N4O2.C2HF3O2/c1-9-12-14-6-10(16(12)5-4-13-9)7-18-8-11(17)15(2)3;3-2(4,5)1(6)7/h6,9,13H,4-5,7-8H2,1-3H3;(H,6,7)
InChIKeyKFGCRXJGTSHFFQ-UHFFFAOYSA-N
MW366.34 g/mol
LogP0.79
Rot. Bonds4

About N,N-dimethyl-2-[(8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-yl)methoxy]acetamide;2,2,2-trifluoroacetic acid

N,N-dimethyl-2-[(8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-yl)methoxy]acetamide;2,2,2-trifluoroacetic acid (PubChem CID 155828587) has the molecular formula C14H21F3N4O4 and a molecular weight of 366.34 g/mol. Its IUPAC name is N,N-dimethyl-2-[(8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-yl)methoxy]acetamide;2,2,2-trifluoroacetic acid.

Molecular Properties

Compound NameN,N-dimethyl-2-[(8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-yl)methoxy]acetamide;2,2,2-trifluoroacetic acid
PubChem CID155828587
Molecular FormulaC14H21F3N4O4
Molecular Weight366.34 g/mol
Exact Mass366.15
IUPAC NameN,N-dimethyl-2-[(8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-yl)methoxy]acetamide;2,2,2-trifluoroacetic acid
SMILESCC1NCCn2c(COCC(=O)N(C)C)cnc21.O=C(O)C(F)(F)F
InChIInChI=1S/C12H20N4O2.C2HF3O2/c1-9-12-14-6-10(16(12)5-4-13-9)7-18-8-11(17)15(2)3;3-2(4,5)1(6)7/h6,9,13H,4-5,7-8H2,1-3H3;(H,6,7)
InChIKeyKFGCRXJGTSHFFQ-UHFFFAOYSA-N
XLogP0.79
TPSA96.69 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.34
LogP ≤ 50.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze N,N-dimethyl-2-[(8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-yl)methoxy]acetamide;2,2,2-trifluoroacetic acid with MolForge

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Related Compounds

N-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-2-(2,2,2-trifluoroethoxy)acetamide
CID 86772694
3-(cyclopropylmethoxymethyl)-7,8-dimethyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine;2,2,2-trifluoroacetic acid
CID 118742724
7-cyclobutyl-3-(methoxymethyl)-8-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine;2,2,2-trifluoroacetic acid
CID 118743400
7-cyclopentyl-3-(methoxymethyl)-8-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine;2,2,2-trifluoroacetic acid
CID 118743402
N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-2-(2,2,2-trifluoroethoxy)acetamide
CID 97846362
N-[(6R)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-2-(2,2,2-trifluoroethoxy)acetamide
CID 97846363
2-[(7,8-dimethyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl)methoxy]-1-pyrrolidin-1-ylethanone;2,2,2-trifluoroacetic acid
CID 155825441
3-(cyclopropylmethoxymethyl)-8-methyl-7-propan-2-yl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine;2,2,2-trifluoroacetic acid
CID 155825901
2-[(7-cyclopentyl-8-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl)methoxy]-N,N-dimethylacetamide;2,2,2-trifluoroacetic acid
CID 155831755
1-[2-[(dimethylamino)methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-2-methoxyethanone;2,2,2-trifluoroacetic acid
CID 155834069
1-[2-[(dimethylamino)methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-2-ethoxyethanone;2,2,2-trifluoroacetic acid
CID 155834282
2-[[7-(cyclopropylmethyl)-8-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]methoxy]-1-pyrrolidin-1-ylethanone;2,2,2-trifluoroacetic acid
CID 155843201

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-[(8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-yl)methoxy]acetamide;2,2,2-trifluoroacetic acid?
The IUPAC name of N,N-dimethyl-2-[(8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-yl)methoxy]acetamide;2,2,2-trifluoroacetic acid (CID 155828587) is N,N-dimethyl-2-[(8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-yl)methoxy]acetamide;2,2,2-trifluoroacetic acid.
What is the SMILES notation for N,N-dimethyl-2-[(8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-yl)methoxy]acetamide;2,2,2-trifluoroacetic acid?
The canonical SMILES for N,N-dimethyl-2-[(8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-yl)methoxy]acetamide;2,2,2-trifluoroacetic acid is CC1NCCn2c(COCC(=O)N(C)C)cnc21.O=C(O)C(F)(F)F.
What is the InChIKey of N,N-dimethyl-2-[(8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-yl)methoxy]acetamide;2,2,2-trifluoroacetic acid?
The InChIKey is KFGCRXJGTSHFFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O2.C2HF3O2/c1-9-12-14-6-10(16(12)5-4-13-9)7-18-8-11(17)15(2)3;3-2(4,5)1(6)7/h6,9,13H,4-5,7-8H2,1-3H3;(H,6,7).
What are the key properties of N,N-dimethyl-2-[(8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-yl)methoxy]acetamide;2,2,2-trifluoroacetic acid?
N,N-dimethyl-2-[(8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-yl)methoxy]acetamide;2,2,2-trifluoroacetic acid has a molecular weight of 366.34 g/mol, XLogP of 0.79, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-[(8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-yl)methoxy]acetamide;2,2,2-trifluoroacetic acid is sourced from PubChem (CID 155828587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).