5-(methoxymethyl)-1-methylpyrazol-3-amine

C6H11N3O — CID 58043777

IUPAC5-(methoxymethyl)-1-methylpyrazol-3-amine
SMILESCOCc1cc(N)nn1C
InChIInChI=1S/C6H11N3O/c1-9-5(4-10-2)3-6(7)8-9/h3H,4H2,1-2H3,(H2,7,8)
InChIKeyKJTMKVRSTYLHQN-UHFFFAOYSA-N
MW141.17 g/mol
LogP0.15
Rot. Bonds2

About 5-(methoxymethyl)-1-methylpyrazol-3-amine

5-(methoxymethyl)-1-methylpyrazol-3-amine (PubChem CID 58043777) has the molecular formula C6H11N3O and a molecular weight of 141.17 g/mol. Its IUPAC name is 5-(methoxymethyl)-1-methylpyrazol-3-amine.

Molecular Properties

Compound Name5-(methoxymethyl)-1-methylpyrazol-3-amine
PubChem CID58043777
Molecular FormulaC6H11N3O
Molecular Weight141.17 g/mol
Exact Mass141.09
IUPAC Name5-(methoxymethyl)-1-methylpyrazol-3-amine
SMILESCOCc1cc(N)nn1C
InChIInChI=1S/C6H11N3O/c1-9-5(4-10-2)3-6(7)8-9/h3H,4H2,1-2H3,(H2,7,8)
InChIKeyKJTMKVRSTYLHQN-UHFFFAOYSA-N
XLogP0.15
TPSA53.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.17
LogP ≤ 50.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(methoxymethyl)-1-methylpyrazol-3-amine?
The IUPAC name of 5-(methoxymethyl)-1-methylpyrazol-3-amine (CID 58043777) is 5-(methoxymethyl)-1-methylpyrazol-3-amine.
What is the SMILES notation for 5-(methoxymethyl)-1-methylpyrazol-3-amine?
The canonical SMILES for 5-(methoxymethyl)-1-methylpyrazol-3-amine is COCc1cc(N)nn1C.
What is the InChIKey of 5-(methoxymethyl)-1-methylpyrazol-3-amine?
The InChIKey is KJTMKVRSTYLHQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N3O/c1-9-5(4-10-2)3-6(7)8-9/h3H,4H2,1-2H3,(H2,7,8).
What are the key properties of 5-(methoxymethyl)-1-methylpyrazol-3-amine?
5-(methoxymethyl)-1-methylpyrazol-3-amine has a molecular weight of 141.17 g/mol, XLogP of 0.15, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(methoxymethyl)-1-methylpyrazol-3-amine is sourced from PubChem (CID 58043777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).