6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazin-3-yl-[4-(2-methoxyethyl)piperazin-1-yl]methanone

C14H22N4O3 — CID 90537293

IUPAC6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazin-3-yl-[4-(2-methoxyethyl)piperazin-1-yl]methanone
SMILESCOCCN1CCN(C(=O)c2cnn3c2OCCC3)CC1
InChIInChI=1S/C14H22N4O3/c1-20-10-8-16-4-6-17(7-5-16)13(19)12-11-15-18-3-2-9-21-14(12)18/h11H,2-10H2,1H3
InChIKeyOIXVLXPNKKGUIF-UHFFFAOYSA-N
MW294.35 g/mol
LogP0.07
Rot. Bonds4

About 6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazin-3-yl-[4-(2-methoxyethyl)piperazin-1-yl]methanone

6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazin-3-yl-[4-(2-methoxyethyl)piperazin-1-yl]methanone (PubChem CID 90537293) has the molecular formula C14H22N4O3 and a molecular weight of 294.35 g/mol. Its IUPAC name is 6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazin-3-yl-[4-(2-methoxyethyl)piperazin-1-yl]methanone.

Molecular Properties

Compound Name6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazin-3-yl-[4-(2-methoxyethyl)piperazin-1-yl]methanone
PubChem CID90537293
Molecular FormulaC14H22N4O3
Molecular Weight294.35 g/mol
Exact Mass294.17
IUPAC Name6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazin-3-yl-[4-(2-methoxyethyl)piperazin-1-yl]methanone
SMILESCOCCN1CCN(C(=O)c2cnn3c2OCCC3)CC1
InChIInChI=1S/C14H22N4O3/c1-20-10-8-16-4-6-17(7-5-16)13(19)12-11-15-18-3-2-9-21-14(12)18/h11H,2-10H2,1H3
InChIKeyOIXVLXPNKKGUIF-UHFFFAOYSA-N
XLogP0.07
TPSA59.83 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.35
LogP ≤ 50.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazin-3-yl-[4-(2-methoxyethyl)piperazin-1-yl]methanone 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 6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazin-3-yl-[4-(2-methoxyethyl)piperazin-1-yl]methanone?
The IUPAC name of 6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazin-3-yl-[4-(2-methoxyethyl)piperazin-1-yl]methanone (CID 90537293) is 6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazin-3-yl-[4-(2-methoxyethyl)piperazin-1-yl]methanone.
What is the SMILES notation for 6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazin-3-yl-[4-(2-methoxyethyl)piperazin-1-yl]methanone?
The canonical SMILES for 6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazin-3-yl-[4-(2-methoxyethyl)piperazin-1-yl]methanone is COCCN1CCN(C(=O)c2cnn3c2OCCC3)CC1.
What is the InChIKey of 6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazin-3-yl-[4-(2-methoxyethyl)piperazin-1-yl]methanone?
The InChIKey is OIXVLXPNKKGUIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O3/c1-20-10-8-16-4-6-17(7-5-16)13(19)12-11-15-18-3-2-9-21-14(12)18/h11H,2-10H2,1H3.
What are the key properties of 6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazin-3-yl-[4-(2-methoxyethyl)piperazin-1-yl]methanone?
6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazin-3-yl-[4-(2-methoxyethyl)piperazin-1-yl]methanone has a molecular weight of 294.35 g/mol, XLogP of 0.07, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazin-3-yl-[4-(2-methoxyethyl)piperazin-1-yl]methanone is sourced from PubChem (CID 90537293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).