N-[[7-(oxan-4-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]methyl]-1,2-oxazole-5-carboxamide

C17H23N5O3 — CID 97392176

IUPACN-[[7-(oxan-4-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]methyl]-1,2-oxazole-5-carboxamide
SMILESO=C(NCc1cnc2n1CCN(CC1CCOCC1)C2)c1ccno1
InChIInChI=1S/C17H23N5O3/c23-17(15-1-4-20-25-15)19-10-14-9-18-16-12-21(5-6-22(14)16)11-13-2-7-24-8-3-13/h1,4,9,13H,2-3,5-8,10-12H2,(H,19,23)
InChIKeySIANQCAOIWGBRU-UHFFFAOYSA-N
MW345.40 g/mol
LogP1.04
Rot. Bonds5

About N-[[7-(oxan-4-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]methyl]-1,2-oxazole-5-carboxamide

N-[[7-(oxan-4-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]methyl]-1,2-oxazole-5-carboxamide (PubChem CID 97392176) has the molecular formula C17H23N5O3 and a molecular weight of 345.40 g/mol. Its IUPAC name is N-[[7-(oxan-4-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]methyl]-1,2-oxazole-5-carboxamide.

Molecular Properties

Compound NameN-[[7-(oxan-4-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]methyl]-1,2-oxazole-5-carboxamide
PubChem CID97392176
Molecular FormulaC17H23N5O3
Molecular Weight345.40 g/mol
Exact Mass345.18
IUPAC NameN-[[7-(oxan-4-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]methyl]-1,2-oxazole-5-carboxamide
SMILESO=C(NCc1cnc2n1CCN(CC1CCOCC1)C2)c1ccno1
InChIInChI=1S/C17H23N5O3/c23-17(15-1-4-20-25-15)19-10-14-9-18-16-12-21(5-6-22(14)16)11-13-2-7-24-8-3-13/h1,4,9,13H,2-3,5-8,10-12H2,(H,19,23)
InChIKeySIANQCAOIWGBRU-UHFFFAOYSA-N
XLogP1.04
TPSA85.42 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.40
LogP ≤ 51.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze N-[[7-(oxan-4-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]methyl]-1,2-oxazole-5-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[[7-(oxan-4-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]methyl]-1,2-oxazole-5-carboxamide?
The IUPAC name of N-[[7-(oxan-4-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]methyl]-1,2-oxazole-5-carboxamide (CID 97392176) is N-[[7-(oxan-4-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]methyl]-1,2-oxazole-5-carboxamide.
What is the SMILES notation for N-[[7-(oxan-4-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]methyl]-1,2-oxazole-5-carboxamide?
The canonical SMILES for N-[[7-(oxan-4-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]methyl]-1,2-oxazole-5-carboxamide is O=C(NCc1cnc2n1CCN(CC1CCOCC1)C2)c1ccno1.
What is the InChIKey of N-[[7-(oxan-4-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]methyl]-1,2-oxazole-5-carboxamide?
The InChIKey is SIANQCAOIWGBRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N5O3/c23-17(15-1-4-20-25-15)19-10-14-9-18-16-12-21(5-6-22(14)16)11-13-2-7-24-8-3-13/h1,4,9,13H,2-3,5-8,10-12H2,(H,19,23).
What are the key properties of N-[[7-(oxan-4-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]methyl]-1,2-oxazole-5-carboxamide?
N-[[7-(oxan-4-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]methyl]-1,2-oxazole-5-carboxamide has a molecular weight of 345.40 g/mol, XLogP of 1.04, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[7-(oxan-4-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]methyl]-1,2-oxazole-5-carboxamide is sourced from PubChem (CID 97392176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).