4-[(2-methoxyethylamino)methyl]-N,1,3-trimethyl-N-(oxolan-3-yl)pyrazol-5-amine

C14H26N4O2 — CID 82742332

IUPAC4-[(2-methoxyethylamino)methyl]-N,1,3-trimethyl-N-(oxolan-3-yl)pyrazol-5-amine
SMILESCOCCNCc1c(C)nn(C)c1N(C)C1CCOC1
InChIInChI=1S/C14H26N4O2/c1-11-13(9-15-6-8-19-4)14(18(3)16-11)17(2)12-5-7-20-10-12/h12,15H,5-10H2,1-4H3
InChIKeyHVOYWYQKHPIXKT-UHFFFAOYSA-N
MW282.39 g/mol
LogP0.69
Rot. Bonds7

About 4-[(2-methoxyethylamino)methyl]-N,1,3-trimethyl-N-(oxolan-3-yl)pyrazol-5-amine

4-[(2-methoxyethylamino)methyl]-N,1,3-trimethyl-N-(oxolan-3-yl)pyrazol-5-amine (PubChem CID 82742332) has the molecular formula C14H26N4O2 and a molecular weight of 282.39 g/mol. Its IUPAC name is 4-[(2-methoxyethylamino)methyl]-N,1,3-trimethyl-N-(oxolan-3-yl)pyrazol-5-amine.

Molecular Properties

Compound Name4-[(2-methoxyethylamino)methyl]-N,1,3-trimethyl-N-(oxolan-3-yl)pyrazol-5-amine
PubChem CID82742332
Molecular FormulaC14H26N4O2
Molecular Weight282.39 g/mol
Exact Mass282.21
IUPAC Name4-[(2-methoxyethylamino)methyl]-N,1,3-trimethyl-N-(oxolan-3-yl)pyrazol-5-amine
SMILESCOCCNCc1c(C)nn(C)c1N(C)C1CCOC1
InChIInChI=1S/C14H26N4O2/c1-11-13(9-15-6-8-19-4)14(18(3)16-11)17(2)12-5-7-20-10-12/h12,15H,5-10H2,1-4H3
InChIKeyHVOYWYQKHPIXKT-UHFFFAOYSA-N
XLogP0.69
TPSA51.55 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.39
LogP ≤ 50.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-[(2-methoxyethylamino)methyl]-N,1,3-trimethyl-N-(oxolan-3-yl)pyrazol-5-amine?
The IUPAC name of 4-[(2-methoxyethylamino)methyl]-N,1,3-trimethyl-N-(oxolan-3-yl)pyrazol-5-amine (CID 82742332) is 4-[(2-methoxyethylamino)methyl]-N,1,3-trimethyl-N-(oxolan-3-yl)pyrazol-5-amine.
What is the SMILES notation for 4-[(2-methoxyethylamino)methyl]-N,1,3-trimethyl-N-(oxolan-3-yl)pyrazol-5-amine?
The canonical SMILES for 4-[(2-methoxyethylamino)methyl]-N,1,3-trimethyl-N-(oxolan-3-yl)pyrazol-5-amine is COCCNCc1c(C)nn(C)c1N(C)C1CCOC1.
What is the InChIKey of 4-[(2-methoxyethylamino)methyl]-N,1,3-trimethyl-N-(oxolan-3-yl)pyrazol-5-amine?
The InChIKey is HVOYWYQKHPIXKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4O2/c1-11-13(9-15-6-8-19-4)14(18(3)16-11)17(2)12-5-7-20-10-12/h12,15H,5-10H2,1-4H3.
What are the key properties of 4-[(2-methoxyethylamino)methyl]-N,1,3-trimethyl-N-(oxolan-3-yl)pyrazol-5-amine?
4-[(2-methoxyethylamino)methyl]-N,1,3-trimethyl-N-(oxolan-3-yl)pyrazol-5-amine has a molecular weight of 282.39 g/mol, XLogP of 0.69, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-methoxyethylamino)methyl]-N,1,3-trimethyl-N-(oxolan-3-yl)pyrazol-5-amine is sourced from PubChem (CID 82742332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).