[3-(methoxymethyl)-8-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-(6-methyl-3-pyridinyl)methanone

C16H20N4O2 — CID 131644098

IUPAC[3-(methoxymethyl)-8-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-(6-methyl-3-pyridinyl)methanone
SMILESCOCc1cnc2n1CCN(C(=O)c1ccc(C)nc1)C2C
InChIInChI=1S/C16H20N4O2/c1-11-4-5-13(8-17-11)16(21)19-6-7-20-14(10-22-3)9-18-15(20)12(19)2/h4-5,8-9,12H,6-7,10H2,1-3H3
InChIKeyLTYSWKSQXNSXPN-UHFFFAOYSA-N
MW300.36 g/mol
LogP1.95
Rot. Bonds3

About [3-(methoxymethyl)-8-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-(6-methyl-3-pyridinyl)methanone

[3-(methoxymethyl)-8-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-(6-methyl-3-pyridinyl)methanone (PubChem CID 131644098) has the molecular formula C16H20N4O2 and a molecular weight of 300.36 g/mol. Its IUPAC name is [3-(methoxymethyl)-8-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-(6-methyl-3-pyridinyl)methanone.

Molecular Properties

Compound Name[3-(methoxymethyl)-8-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-(6-methyl-3-pyridinyl)methanone
PubChem CID131644098
Molecular FormulaC16H20N4O2
Molecular Weight300.36 g/mol
Exact Mass300.16
IUPAC Name[3-(methoxymethyl)-8-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-(6-methyl-3-pyridinyl)methanone
SMILESCOCc1cnc2n1CCN(C(=O)c1ccc(C)nc1)C2C
InChIInChI=1S/C16H20N4O2/c1-11-4-5-13(8-17-11)16(21)19-6-7-20-14(10-22-3)9-18-15(20)12(19)2/h4-5,8-9,12H,6-7,10H2,1-3H3
InChIKeyLTYSWKSQXNSXPN-UHFFFAOYSA-N
XLogP1.95
TPSA60.25 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.36
LogP ≤ 51.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [3-(methoxymethyl)-8-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-(6-methyl-3-pyridinyl)methanone?
The IUPAC name of [3-(methoxymethyl)-8-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-(6-methyl-3-pyridinyl)methanone (CID 131644098) is [3-(methoxymethyl)-8-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-(6-methyl-3-pyridinyl)methanone.
What is the SMILES notation for [3-(methoxymethyl)-8-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-(6-methyl-3-pyridinyl)methanone?
The canonical SMILES for [3-(methoxymethyl)-8-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-(6-methyl-3-pyridinyl)methanone is COCc1cnc2n1CCN(C(=O)c1ccc(C)nc1)C2C.
What is the InChIKey of [3-(methoxymethyl)-8-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-(6-methyl-3-pyridinyl)methanone?
The InChIKey is LTYSWKSQXNSXPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O2/c1-11-4-5-13(8-17-11)16(21)19-6-7-20-14(10-22-3)9-18-15(20)12(19)2/h4-5,8-9,12H,6-7,10H2,1-3H3.
What are the key properties of [3-(methoxymethyl)-8-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-(6-methyl-3-pyridinyl)methanone?
[3-(methoxymethyl)-8-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-(6-methyl-3-pyridinyl)methanone has a molecular weight of 300.36 g/mol, XLogP of 1.95, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(methoxymethyl)-8-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-(6-methyl-3-pyridinyl)methanone is sourced from PubChem (CID 131644098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).