N-(2-methoxyethyl)-N-methyl-1H-pyrazol-4-amine

C7H13N3O — CID 175775371

IUPACN-(2-methoxyethyl)-N-methyl-1H-pyrazol-4-amine
SMILESCOCCN(C)c1cn[nH]c1
InChIInChI=1S/C7H13N3O/c1-10(3-4-11-2)7-5-8-9-6-7/h5-6H,3-4H2,1-2H3,(H,8,9)
InChIKeyUCOJVAKTUFYKBC-UHFFFAOYSA-N
MW155.20 g/mol
LogP0.49
Rot. Bonds4

About N-(2-methoxyethyl)-N-methyl-1H-pyrazol-4-amine

N-(2-methoxyethyl)-N-methyl-1H-pyrazol-4-amine (PubChem CID 175775371) has the molecular formula C7H13N3O and a molecular weight of 155.20 g/mol. Its IUPAC name is N-(2-methoxyethyl)-N-methyl-1H-pyrazol-4-amine.

Molecular Properties

Compound NameN-(2-methoxyethyl)-N-methyl-1H-pyrazol-4-amine
PubChem CID175775371
Molecular FormulaC7H13N3O
Molecular Weight155.20 g/mol
Exact Mass155.11
IUPAC NameN-(2-methoxyethyl)-N-methyl-1H-pyrazol-4-amine
SMILESCOCCN(C)c1cn[nH]c1
InChIInChI=1S/C7H13N3O/c1-10(3-4-11-2)7-5-8-9-6-7/h5-6H,3-4H2,1-2H3,(H,8,9)
InChIKeyUCOJVAKTUFYKBC-UHFFFAOYSA-N
XLogP0.49
TPSA41.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.20
LogP ≤ 50.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-N-methyl-1H-pyrazol-4-amine?
The IUPAC name of N-(2-methoxyethyl)-N-methyl-1H-pyrazol-4-amine (CID 175775371) is N-(2-methoxyethyl)-N-methyl-1H-pyrazol-4-amine.
What is the SMILES notation for N-(2-methoxyethyl)-N-methyl-1H-pyrazol-4-amine?
The canonical SMILES for N-(2-methoxyethyl)-N-methyl-1H-pyrazol-4-amine is COCCN(C)c1cn[nH]c1.
What is the InChIKey of N-(2-methoxyethyl)-N-methyl-1H-pyrazol-4-amine?
The InChIKey is UCOJVAKTUFYKBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13N3O/c1-10(3-4-11-2)7-5-8-9-6-7/h5-6H,3-4H2,1-2H3,(H,8,9).
What are the key properties of N-(2-methoxyethyl)-N-methyl-1H-pyrazol-4-amine?
N-(2-methoxyethyl)-N-methyl-1H-pyrazol-4-amine has a molecular weight of 155.20 g/mol, XLogP of 0.49, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-N-methyl-1H-pyrazol-4-amine is sourced from PubChem (CID 175775371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).