1-methyl-N-[[7-(oxan-4-yl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]methyl]pyrazole-4-carboxamide

C17H24N6O2 — CID 97467597

IUPAC1-methyl-N-[[7-(oxan-4-yl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]methyl]pyrazole-4-carboxamide
SMILESCn1cc(C(=O)NCc2cn3c(n2)CN(C2CCOCC2)CC3)cn1
InChIInChI=1S/C17H24N6O2/c1-21-10-13(8-19-21)17(24)18-9-14-11-23-5-4-22(12-16(23)20-14)15-2-6-25-7-3-15/h8,10-11,15H,2-7,9,12H2,1H3,(H,18,24)
InChIKeyMRAQIBKWUFCMAB-UHFFFAOYSA-N
MW344.42 g/mol
LogP0.54
Rot. Bonds4

About 1-methyl-N-[[7-(oxan-4-yl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]methyl]pyrazole-4-carboxamide

1-methyl-N-[[7-(oxan-4-yl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]methyl]pyrazole-4-carboxamide (PubChem CID 97467597) has the molecular formula C17H24N6O2 and a molecular weight of 344.42 g/mol. Its IUPAC name is 1-methyl-N-[[7-(oxan-4-yl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]methyl]pyrazole-4-carboxamide.

Molecular Properties

Compound Name1-methyl-N-[[7-(oxan-4-yl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]methyl]pyrazole-4-carboxamide
PubChem CID97467597
Molecular FormulaC17H24N6O2
Molecular Weight344.42 g/mol
Exact Mass344.20
IUPAC Name1-methyl-N-[[7-(oxan-4-yl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]methyl]pyrazole-4-carboxamide
SMILESCn1cc(C(=O)NCc2cn3c(n2)CN(C2CCOCC2)CC3)cn1
InChIInChI=1S/C17H24N6O2/c1-21-10-13(8-19-21)17(24)18-9-14-11-23-5-4-22(12-16(23)20-14)15-2-6-25-7-3-15/h8,10-11,15H,2-7,9,12H2,1H3,(H,18,24)
InChIKeyMRAQIBKWUFCMAB-UHFFFAOYSA-N
XLogP0.54
TPSA77.21 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.42
LogP ≤ 50.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-[[7-(oxan-4-yl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]methyl]pyrazole-4-carboxamide?
The IUPAC name of 1-methyl-N-[[7-(oxan-4-yl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]methyl]pyrazole-4-carboxamide (CID 97467597) is 1-methyl-N-[[7-(oxan-4-yl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]methyl]pyrazole-4-carboxamide.
What is the SMILES notation for 1-methyl-N-[[7-(oxan-4-yl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]methyl]pyrazole-4-carboxamide?
The canonical SMILES for 1-methyl-N-[[7-(oxan-4-yl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]methyl]pyrazole-4-carboxamide is Cn1cc(C(=O)NCc2cn3c(n2)CN(C2CCOCC2)CC3)cn1.
What is the InChIKey of 1-methyl-N-[[7-(oxan-4-yl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]methyl]pyrazole-4-carboxamide?
The InChIKey is MRAQIBKWUFCMAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N6O2/c1-21-10-13(8-19-21)17(24)18-9-14-11-23-5-4-22(12-16(23)20-14)15-2-6-25-7-3-15/h8,10-11,15H,2-7,9,12H2,1H3,(H,18,24).
What are the key properties of 1-methyl-N-[[7-(oxan-4-yl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]methyl]pyrazole-4-carboxamide?
1-methyl-N-[[7-(oxan-4-yl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]methyl]pyrazole-4-carboxamide has a molecular weight of 344.42 g/mol, XLogP of 0.54, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-[[7-(oxan-4-yl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]methyl]pyrazole-4-carboxamide is sourced from PubChem (CID 97467597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).