3-(methoxymethyl)-2,3-dihydro-1H-pyrazole

C5H10N2O — CID 175354862

IUPAC3-(methoxymethyl)-2,3-dihydro-1H-pyrazole
SMILESCOCC1C=CNN1
InChIInChI=1S/C5H10N2O/c1-8-4-5-2-3-6-7-5/h2-3,5-7H,4H2,1H3
InChIKeyOJCWWVIWPFIOAS-UHFFFAOYSA-N
MW114.15 g/mol
LogP-0.38
Rot. Bonds2

About 3-(methoxymethyl)-2,3-dihydro-1H-pyrazole

3-(methoxymethyl)-2,3-dihydro-1H-pyrazole (PubChem CID 175354862) has the molecular formula C5H10N2O and a molecular weight of 114.15 g/mol. Its IUPAC name is 3-(methoxymethyl)-2,3-dihydro-1H-pyrazole.

Molecular Properties

Compound Name3-(methoxymethyl)-2,3-dihydro-1H-pyrazole
PubChem CID175354862
Molecular FormulaC5H10N2O
Molecular Weight114.15 g/mol
Exact Mass114.08
IUPAC Name3-(methoxymethyl)-2,3-dihydro-1H-pyrazole
SMILESCOCC1C=CNN1
InChIInChI=1S/C5H10N2O/c1-8-4-5-2-3-6-7-5/h2-3,5-7H,4H2,1H3
InChIKeyOJCWWVIWPFIOAS-UHFFFAOYSA-N
XLogP-0.38
TPSA33.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500114.15
LogP ≤ 5-0.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

ethyl 2,3-dihydro-1H-pyrazole-3-carboximidate
CID 143231315
2-(2,3-dihydro-1H-pyrazol-3-ylmethoxy)ethyl-trimethylsilane
CID 175099424
1-Methoxybut-3-en-2-ylhydrazine
CID 105207123
1-Propoxybut-3-en-2-ylhydrazine
CID 105209911
1-Ethoxybut-3-en-2-ylhydrazine
CID 105235208
4-Methoxypent-1-en-3-ylhydrazine
CID 105246826
CID 154185185
CID 154185185

Frequently Asked Questions

What is the IUPAC name of 3-(methoxymethyl)-2,3-dihydro-1H-pyrazole?
The IUPAC name of 3-(methoxymethyl)-2,3-dihydro-1H-pyrazole (CID 175354862) is 3-(methoxymethyl)-2,3-dihydro-1H-pyrazole.
What is the SMILES notation for 3-(methoxymethyl)-2,3-dihydro-1H-pyrazole?
The canonical SMILES for 3-(methoxymethyl)-2,3-dihydro-1H-pyrazole is COCC1C=CNN1.
What is the InChIKey of 3-(methoxymethyl)-2,3-dihydro-1H-pyrazole?
The InChIKey is OJCWWVIWPFIOAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N2O/c1-8-4-5-2-3-6-7-5/h2-3,5-7H,4H2,1H3.
What are the key properties of 3-(methoxymethyl)-2,3-dihydro-1H-pyrazole?
3-(methoxymethyl)-2,3-dihydro-1H-pyrazole has a molecular weight of 114.15 g/mol, XLogP of -0.38, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(methoxymethyl)-2,3-dihydro-1H-pyrazole is sourced from PubChem (CID 175354862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).