8-methyl-7-[(1-methylpyrazol-4-yl)methyl]-3-(pyridin-3-yloxymethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine

C18H22N6O — CID 118746613

IUPAC8-methyl-7-[(1-methylpyrazol-4-yl)methyl]-3-(pyridin-3-yloxymethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine
SMILESCC1c2ncc(COc3cccnc3)n2CCN1Cc1cnn(C)c1
InChIInChI=1S/C18H22N6O/c1-14-18-20-9-16(13-25-17-4-3-5-19-10-17)24(18)7-6-23(14)12-15-8-21-22(2)11-15/h3-5,8-11,14H,6-7,12-13H2,1-2H3
InChIKeyWYRRVIFUTJREJZ-UHFFFAOYSA-N
MW338.42 g/mol
LogP2.17
Rot. Bonds5

About 8-methyl-7-[(1-methylpyrazol-4-yl)methyl]-3-(pyridin-3-yloxymethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine

8-methyl-7-[(1-methylpyrazol-4-yl)methyl]-3-(pyridin-3-yloxymethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine (PubChem CID 118746613) has the molecular formula C18H22N6O and a molecular weight of 338.42 g/mol. Its IUPAC name is 8-methyl-7-[(1-methylpyrazol-4-yl)methyl]-3-(pyridin-3-yloxymethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine.

Molecular Properties

Compound Name8-methyl-7-[(1-methylpyrazol-4-yl)methyl]-3-(pyridin-3-yloxymethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine
PubChem CID118746613
Molecular FormulaC18H22N6O
Molecular Weight338.42 g/mol
Exact Mass338.19
IUPAC Name8-methyl-7-[(1-methylpyrazol-4-yl)methyl]-3-(pyridin-3-yloxymethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine
SMILESCC1c2ncc(COc3cccnc3)n2CCN1Cc1cnn(C)c1
InChIInChI=1S/C18H22N6O/c1-14-18-20-9-16(13-25-17-4-3-5-19-10-17)24(18)7-6-23(14)12-15-8-21-22(2)11-15/h3-5,8-11,14H,6-7,12-13H2,1-2H3
InChIKeyWYRRVIFUTJREJZ-UHFFFAOYSA-N
XLogP2.17
TPSA61.00 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.42
LogP ≤ 52.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 8-methyl-7-[(1-methylpyrazol-4-yl)methyl]-3-(pyridin-3-yloxymethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine?
The IUPAC name of 8-methyl-7-[(1-methylpyrazol-4-yl)methyl]-3-(pyridin-3-yloxymethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine (CID 118746613) is 8-methyl-7-[(1-methylpyrazol-4-yl)methyl]-3-(pyridin-3-yloxymethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine.
What is the SMILES notation for 8-methyl-7-[(1-methylpyrazol-4-yl)methyl]-3-(pyridin-3-yloxymethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine?
The canonical SMILES for 8-methyl-7-[(1-methylpyrazol-4-yl)methyl]-3-(pyridin-3-yloxymethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine is CC1c2ncc(COc3cccnc3)n2CCN1Cc1cnn(C)c1.
What is the InChIKey of 8-methyl-7-[(1-methylpyrazol-4-yl)methyl]-3-(pyridin-3-yloxymethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine?
The InChIKey is WYRRVIFUTJREJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N6O/c1-14-18-20-9-16(13-25-17-4-3-5-19-10-17)24(18)7-6-23(14)12-15-8-21-22(2)11-15/h3-5,8-11,14H,6-7,12-13H2,1-2H3.
What are the key properties of 8-methyl-7-[(1-methylpyrazol-4-yl)methyl]-3-(pyridin-3-yloxymethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine?
8-methyl-7-[(1-methylpyrazol-4-yl)methyl]-3-(pyridin-3-yloxymethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine has a molecular weight of 338.42 g/mol, XLogP of 2.17, 5 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-7-[(1-methylpyrazol-4-yl)methyl]-3-(pyridin-3-yloxymethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine is sourced from PubChem (CID 118746613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).