1-[2-[[methyl(propan-2-yl)amino]methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-2-phenylethanone

C19H26N4O — CID 97467347

IUPAC1-[2-[[methyl(propan-2-yl)amino]methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-2-phenylethanone
SMILESCC(C)N(C)Cc1cn2c(n1)CN(C(=O)Cc1ccccc1)CC2
InChIInChI=1S/C19H26N4O/c1-15(2)21(3)12-17-13-22-9-10-23(14-18(22)20-17)19(24)11-16-7-5-4-6-8-16/h4-8,13,15H,9-12,14H2,1-3H3
InChIKeyZHPMRSYKAQPHNL-UHFFFAOYSA-N
MW326.44 g/mol
LogP2.31
Rot. Bonds5

About 1-[2-[[methyl(propan-2-yl)amino]methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-2-phenylethanone

1-[2-[[methyl(propan-2-yl)amino]methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-2-phenylethanone (PubChem CID 97467347) has the molecular formula C19H26N4O and a molecular weight of 326.44 g/mol. Its IUPAC name is 1-[2-[[methyl(propan-2-yl)amino]methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-2-phenylethanone.

Molecular Properties

Compound Name1-[2-[[methyl(propan-2-yl)amino]methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-2-phenylethanone
PubChem CID97467347
Molecular FormulaC19H26N4O
Molecular Weight326.44 g/mol
Exact Mass326.21
IUPAC Name1-[2-[[methyl(propan-2-yl)amino]methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-2-phenylethanone
SMILESCC(C)N(C)Cc1cn2c(n1)CN(C(=O)Cc1ccccc1)CC2
InChIInChI=1S/C19H26N4O/c1-15(2)21(3)12-17-13-22-9-10-23(14-18(22)20-17)19(24)11-16-7-5-4-6-8-16/h4-8,13,15H,9-12,14H2,1-3H3
InChIKeyZHPMRSYKAQPHNL-UHFFFAOYSA-N
XLogP2.31
TPSA41.37 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.44
LogP ≤ 52.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[2-[[methyl(propan-2-yl)amino]methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-2-phenylethanone?
The IUPAC name of 1-[2-[[methyl(propan-2-yl)amino]methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-2-phenylethanone (CID 97467347) is 1-[2-[[methyl(propan-2-yl)amino]methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-2-phenylethanone.
What is the SMILES notation for 1-[2-[[methyl(propan-2-yl)amino]methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-2-phenylethanone?
The canonical SMILES for 1-[2-[[methyl(propan-2-yl)amino]methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-2-phenylethanone is CC(C)N(C)Cc1cn2c(n1)CN(C(=O)Cc1ccccc1)CC2.
What is the InChIKey of 1-[2-[[methyl(propan-2-yl)amino]methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-2-phenylethanone?
The InChIKey is ZHPMRSYKAQPHNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N4O/c1-15(2)21(3)12-17-13-22-9-10-23(14-18(22)20-17)19(24)11-16-7-5-4-6-8-16/h4-8,13,15H,9-12,14H2,1-3H3.
What are the key properties of 1-[2-[[methyl(propan-2-yl)amino]methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-2-phenylethanone?
1-[2-[[methyl(propan-2-yl)amino]methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-2-phenylethanone has a molecular weight of 326.44 g/mol, XLogP of 2.31, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[[methyl(propan-2-yl)amino]methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-2-phenylethanone is sourced from PubChem (CID 97467347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).