3-(methoxymethyl)-1-propylpyrazole

C8H14N2O — CID 66016916

IUPAC3-(methoxymethyl)-1-propylpyrazole
SMILESCCCn1ccc(COC)n1
InChIInChI=1S/C8H14N2O/c1-3-5-10-6-4-8(9-10)7-11-2/h4,6H,3,5,7H2,1-2H3
InChIKeyGSJYTYYXWWXWCQ-UHFFFAOYSA-N
MW154.21 g/mol
LogP1.44
Rot. Bonds4

About 3-(methoxymethyl)-1-propylpyrazole

3-(methoxymethyl)-1-propylpyrazole (PubChem CID 66016916) has the molecular formula C8H14N2O and a molecular weight of 154.21 g/mol. Its IUPAC name is 3-(methoxymethyl)-1-propylpyrazole.

Molecular Properties

Compound Name3-(methoxymethyl)-1-propylpyrazole
PubChem CID66016916
Molecular FormulaC8H14N2O
Molecular Weight154.21 g/mol
Exact Mass154.11
IUPAC Name3-(methoxymethyl)-1-propylpyrazole
SMILESCCCn1ccc(COC)n1
InChIInChI=1S/C8H14N2O/c1-3-5-10-6-4-8(9-10)7-11-2/h4,6H,3,5,7H2,1-2H3
InChIKeyGSJYTYYXWWXWCQ-UHFFFAOYSA-N
XLogP1.44
TPSA27.05 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.21
LogP ≤ 51.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-(methoxymethyl)-1-(3-methylbutyl)pyrazole
CID 66016329
3-(propan-2-yloxymethyl)-1-propylpyrazole
CID 122170479
3-(butan-2-yloxymethyl)-1-propylpyrazole
CID 122170516
(1-propylpyrazol-3-yl)methanamine
CID 19576818
3-(bromomethyl)-1-propylpyrazole
CID 122165667
3-(bromomethyl)-1-propylpyrazole;hydrobromide
CID 126965597
3-butyl-1-propylpyrazole
CID 90936272
N-methyl-1-(1-propylpyrazol-3-yl)methanamine
CID 19620904
methyl 1-propylpyrazole-3-carboxylate
CID 25247474
2-methyl-N-[(1-propylpyrazol-3-yl)methyl]propan-1-amine;hydrochloride
CID 126968063
3-(butoxymethyl)-1-ethylpyrazole
CID 122170489
2-methoxy-5-methyl-N-[(1-propylpyrazol-3-yl)methyl]aniline
CID 19626016

Frequently Asked Questions

What is the IUPAC name of 3-(methoxymethyl)-1-propylpyrazole?
The IUPAC name of 3-(methoxymethyl)-1-propylpyrazole (CID 66016916) is 3-(methoxymethyl)-1-propylpyrazole.
What is the SMILES notation for 3-(methoxymethyl)-1-propylpyrazole?
The canonical SMILES for 3-(methoxymethyl)-1-propylpyrazole is CCCn1ccc(COC)n1.
What is the InChIKey of 3-(methoxymethyl)-1-propylpyrazole?
The InChIKey is GSJYTYYXWWXWCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O/c1-3-5-10-6-4-8(9-10)7-11-2/h4,6H,3,5,7H2,1-2H3.
What are the key properties of 3-(methoxymethyl)-1-propylpyrazole?
3-(methoxymethyl)-1-propylpyrazole has a molecular weight of 154.21 g/mol, XLogP of 1.44, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(methoxymethyl)-1-propylpyrazole is sourced from PubChem (CID 66016916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).