5-(methoxymethoxymethyl)-1H-pyrazole

C6H10N2O2 — CID 57309644

IUPAC5-(methoxymethoxymethyl)-1H-pyrazole
SMILESCOCOCc1ccn[nH]1
InChIInChI=1S/C6H10N2O2/c1-9-5-10-4-6-2-3-7-8-6/h2-3H,4-5H2,1H3,(H,7,8)
InChIKeyQVEVSOYNEWRZLK-UHFFFAOYSA-N
MW142.16 g/mol
LogP0.53
Rot. Bonds4

About 5-(methoxymethoxymethyl)-1H-pyrazole

5-(methoxymethoxymethyl)-1H-pyrazole (PubChem CID 57309644) has the molecular formula C6H10N2O2 and a molecular weight of 142.16 g/mol. Its IUPAC name is 5-(methoxymethoxymethyl)-1H-pyrazole.

Molecular Properties

Compound Name5-(methoxymethoxymethyl)-1H-pyrazole
PubChem CID57309644
Molecular FormulaC6H10N2O2
Molecular Weight142.16 g/mol
Exact Mass142.07
IUPAC Name5-(methoxymethoxymethyl)-1H-pyrazole
SMILESCOCOCc1ccn[nH]1
InChIInChI=1S/C6H10N2O2/c1-9-5-10-4-6-2-3-7-8-6/h2-3H,4-5H2,1H3,(H,7,8)
InChIKeyQVEVSOYNEWRZLK-UHFFFAOYSA-N
XLogP0.53
TPSA47.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.16
LogP ≤ 50.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 5-(methoxymethoxymethyl)-1H-pyrazole?
The IUPAC name of 5-(methoxymethoxymethyl)-1H-pyrazole (CID 57309644) is 5-(methoxymethoxymethyl)-1H-pyrazole.
What is the SMILES notation for 5-(methoxymethoxymethyl)-1H-pyrazole?
The canonical SMILES for 5-(methoxymethoxymethyl)-1H-pyrazole is COCOCc1ccn[nH]1.
What is the InChIKey of 5-(methoxymethoxymethyl)-1H-pyrazole?
The InChIKey is QVEVSOYNEWRZLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2O2/c1-9-5-10-4-6-2-3-7-8-6/h2-3H,4-5H2,1H3,(H,7,8).
What are the key properties of 5-(methoxymethoxymethyl)-1H-pyrazole?
5-(methoxymethoxymethyl)-1H-pyrazole has a molecular weight of 142.16 g/mol, XLogP of 0.53, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(methoxymethoxymethyl)-1H-pyrazole is sourced from PubChem (CID 57309644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).