2-cyclopropyl-N-[[7-(oxane-4-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]methyl]acetamide

C18H26N4O3 — CID 97382118

IUPAC2-cyclopropyl-N-[[7-(oxane-4-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]methyl]acetamide
SMILESO=C(CC1CC1)NCc1cn2c(n1)CN(C(=O)C1CCOCC1)CC2
InChIInChI=1S/C18H26N4O3/c23-17(9-13-1-2-13)19-10-15-11-21-5-6-22(12-16(21)20-15)18(24)14-3-7-25-8-4-14/h11,13-14H,1-10,12H2,(H,19,23)
InChIKeyFSLSETYUNGSWFJ-UHFFFAOYSA-N
MW346.43 g/mol
LogP1.07
Rot. Bonds5

About 2-cyclopropyl-N-[[7-(oxane-4-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]methyl]acetamide

2-cyclopropyl-N-[[7-(oxane-4-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]methyl]acetamide (PubChem CID 97382118) has the molecular formula C18H26N4O3 and a molecular weight of 346.43 g/mol. Its IUPAC name is 2-cyclopropyl-N-[[7-(oxane-4-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]methyl]acetamide.

Molecular Properties

Compound Name2-cyclopropyl-N-[[7-(oxane-4-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]methyl]acetamide
PubChem CID97382118
Molecular FormulaC18H26N4O3
Molecular Weight346.43 g/mol
Exact Mass346.20
IUPAC Name2-cyclopropyl-N-[[7-(oxane-4-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]methyl]acetamide
SMILESO=C(CC1CC1)NCc1cn2c(n1)CN(C(=O)C1CCOCC1)CC2
InChIInChI=1S/C18H26N4O3/c23-17(9-13-1-2-13)19-10-15-11-21-5-6-22(12-16(21)20-15)18(24)14-3-7-25-8-4-14/h11,13-14H,1-10,12H2,(H,19,23)
InChIKeyFSLSETYUNGSWFJ-UHFFFAOYSA-N
XLogP1.07
TPSA76.46 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.43
LogP ≤ 51.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-N-[[7-(oxane-4-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]methyl]acetamide?
The IUPAC name of 2-cyclopropyl-N-[[7-(oxane-4-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]methyl]acetamide (CID 97382118) is 2-cyclopropyl-N-[[7-(oxane-4-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]methyl]acetamide.
What is the SMILES notation for 2-cyclopropyl-N-[[7-(oxane-4-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]methyl]acetamide?
The canonical SMILES for 2-cyclopropyl-N-[[7-(oxane-4-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]methyl]acetamide is O=C(CC1CC1)NCc1cn2c(n1)CN(C(=O)C1CCOCC1)CC2.
What is the InChIKey of 2-cyclopropyl-N-[[7-(oxane-4-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]methyl]acetamide?
The InChIKey is FSLSETYUNGSWFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N4O3/c23-17(9-13-1-2-13)19-10-15-11-21-5-6-22(12-16(21)20-15)18(24)14-3-7-25-8-4-14/h11,13-14H,1-10,12H2,(H,19,23).
What are the key properties of 2-cyclopropyl-N-[[7-(oxane-4-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]methyl]acetamide?
2-cyclopropyl-N-[[7-(oxane-4-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]methyl]acetamide has a molecular weight of 346.43 g/mol, XLogP of 1.07, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-N-[[7-(oxane-4-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]methyl]acetamide is sourced from PubChem (CID 97382118), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).