3-(methoxymethyl)-1-methyl-N-(oxetan-3-yl)pyrazol-4-amine

C9H15N3O2 — CID 130702708

IUPAC3-(methoxymethyl)-1-methyl-N-(oxetan-3-yl)pyrazol-4-amine
SMILESCOCc1nn(C)cc1NC1COC1
InChIInChI=1S/C9H15N3O2/c1-12-3-8(9(11-12)6-13-2)10-7-4-14-5-7/h3,7,10H,4-6H2,1-2H3
InChIKeyPZCUZKHZYHPEHO-UHFFFAOYSA-N
MW197.24 g/mol
LogP0.38
Rot. Bonds4

About 3-(methoxymethyl)-1-methyl-N-(oxetan-3-yl)pyrazol-4-amine

3-(methoxymethyl)-1-methyl-N-(oxetan-3-yl)pyrazol-4-amine (PubChem CID 130702708) has the molecular formula C9H15N3O2 and a molecular weight of 197.24 g/mol. Its IUPAC name is 3-(methoxymethyl)-1-methyl-N-(oxetan-3-yl)pyrazol-4-amine.

Molecular Properties

Compound Name3-(methoxymethyl)-1-methyl-N-(oxetan-3-yl)pyrazol-4-amine
PubChem CID130702708
Molecular FormulaC9H15N3O2
Molecular Weight197.24 g/mol
Exact Mass197.12
IUPAC Name3-(methoxymethyl)-1-methyl-N-(oxetan-3-yl)pyrazol-4-amine
SMILESCOCc1nn(C)cc1NC1COC1
InChIInChI=1S/C9H15N3O2/c1-12-3-8(9(11-12)6-13-2)10-7-4-14-5-7/h3,7,10H,4-6H2,1-2H3
InChIKeyPZCUZKHZYHPEHO-UHFFFAOYSA-N
XLogP0.38
TPSA48.31 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.24
LogP ≤ 50.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-(methoxymethyl)-1-methyl-N-(oxetan-3-yl)pyrazol-4-amine?
The IUPAC name of 3-(methoxymethyl)-1-methyl-N-(oxetan-3-yl)pyrazol-4-amine (CID 130702708) is 3-(methoxymethyl)-1-methyl-N-(oxetan-3-yl)pyrazol-4-amine.
What is the SMILES notation for 3-(methoxymethyl)-1-methyl-N-(oxetan-3-yl)pyrazol-4-amine?
The canonical SMILES for 3-(methoxymethyl)-1-methyl-N-(oxetan-3-yl)pyrazol-4-amine is COCc1nn(C)cc1NC1COC1.
What is the InChIKey of 3-(methoxymethyl)-1-methyl-N-(oxetan-3-yl)pyrazol-4-amine?
The InChIKey is PZCUZKHZYHPEHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O2/c1-12-3-8(9(11-12)6-13-2)10-7-4-14-5-7/h3,7,10H,4-6H2,1-2H3.
What are the key properties of 3-(methoxymethyl)-1-methyl-N-(oxetan-3-yl)pyrazol-4-amine?
3-(methoxymethyl)-1-methyl-N-(oxetan-3-yl)pyrazol-4-amine has a molecular weight of 197.24 g/mol, XLogP of 0.38, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(methoxymethyl)-1-methyl-N-(oxetan-3-yl)pyrazol-4-amine is sourced from PubChem (CID 130702708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).