1-(2-methoxyethyl)-N,N-dimethylpyrazol-4-amine

C8H15N3O — CID 59319950

IUPAC1-(2-methoxyethyl)-N,N-dimethylpyrazol-4-amine
SMILESCOCCn1cc(N(C)C)cn1
InChIInChI=1S/C8H15N3O/c1-10(2)8-6-9-11(7-8)4-5-12-3/h6-7H,4-5H2,1-3H3
InChIKeyUWRFGMWQYDUAOB-UHFFFAOYSA-N
MW169.23 g/mol
LogP0.60
Rot. Bonds4

About 1-(2-methoxyethyl)-N,N-dimethylpyrazol-4-amine

1-(2-methoxyethyl)-N,N-dimethylpyrazol-4-amine (PubChem CID 59319950) has the molecular formula C8H15N3O and a molecular weight of 169.23 g/mol. Its IUPAC name is 1-(2-methoxyethyl)-N,N-dimethylpyrazol-4-amine.

Molecular Properties

Compound Name1-(2-methoxyethyl)-N,N-dimethylpyrazol-4-amine
PubChem CID59319950
Molecular FormulaC8H15N3O
Molecular Weight169.23 g/mol
Exact Mass169.12
IUPAC Name1-(2-methoxyethyl)-N,N-dimethylpyrazol-4-amine
SMILESCOCCn1cc(N(C)C)cn1
InChIInChI=1S/C8H15N3O/c1-10(2)8-6-9-11(7-8)4-5-12-3/h6-7H,4-5H2,1-3H3
InChIKeyUWRFGMWQYDUAOB-UHFFFAOYSA-N
XLogP0.60
TPSA30.29 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.23
LogP ≤ 50.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyethyl)-N,N-dimethylpyrazol-4-amine?
The IUPAC name of 1-(2-methoxyethyl)-N,N-dimethylpyrazol-4-amine (CID 59319950) is 1-(2-methoxyethyl)-N,N-dimethylpyrazol-4-amine.
What is the SMILES notation for 1-(2-methoxyethyl)-N,N-dimethylpyrazol-4-amine?
The canonical SMILES for 1-(2-methoxyethyl)-N,N-dimethylpyrazol-4-amine is COCCn1cc(N(C)C)cn1.
What is the InChIKey of 1-(2-methoxyethyl)-N,N-dimethylpyrazol-4-amine?
The InChIKey is UWRFGMWQYDUAOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N3O/c1-10(2)8-6-9-11(7-8)4-5-12-3/h6-7H,4-5H2,1-3H3.
What are the key properties of 1-(2-methoxyethyl)-N,N-dimethylpyrazol-4-amine?
1-(2-methoxyethyl)-N,N-dimethylpyrazol-4-amine has a molecular weight of 169.23 g/mol, XLogP of 0.60, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyethyl)-N,N-dimethylpyrazol-4-amine is sourced from PubChem (CID 59319950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).