5-ethyl-N-(furan-3-ylmethyl)-4-methyl-1H-pyrazol-3-amine

C11H15N3O — CID 115735786

IUPAC5-ethyl-N-(furan-3-ylmethyl)-4-methyl-1H-pyrazol-3-amine
SMILESCCc1[nH]nc(NCc2ccoc2)c1C
InChIInChI=1S/C11H15N3O/c1-3-10-8(2)11(14-13-10)12-6-9-4-5-15-7-9/h4-5,7H,3,6H2,1-2H3,(H2,12,13,14)
InChIKeyZFAMPLJLWZAJHV-UHFFFAOYSA-N
MW205.26 g/mol
LogP2.49
Rot. Bonds4

About 5-ethyl-N-(furan-3-ylmethyl)-4-methyl-1H-pyrazol-3-amine

5-ethyl-N-(furan-3-ylmethyl)-4-methyl-1H-pyrazol-3-amine (PubChem CID 115735786) has the molecular formula C11H15N3O and a molecular weight of 205.26 g/mol. Its IUPAC name is 5-ethyl-N-(furan-3-ylmethyl)-4-methyl-1H-pyrazol-3-amine.

Molecular Properties

Compound Name5-ethyl-N-(furan-3-ylmethyl)-4-methyl-1H-pyrazol-3-amine
PubChem CID115735786
Molecular FormulaC11H15N3O
Molecular Weight205.26 g/mol
Exact Mass205.12
IUPAC Name5-ethyl-N-(furan-3-ylmethyl)-4-methyl-1H-pyrazol-3-amine
SMILESCCc1[nH]nc(NCc2ccoc2)c1C
InChIInChI=1S/C11H15N3O/c1-3-10-8(2)11(14-13-10)12-6-9-4-5-15-7-9/h4-5,7H,3,6H2,1-2H3,(H2,12,13,14)
InChIKeyZFAMPLJLWZAJHV-UHFFFAOYSA-N
XLogP2.49
TPSA53.85 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 52.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-ethyl-N-(furan-3-ylmethyl)-4-methyl-1H-pyrazol-3-amine?
The IUPAC name of 5-ethyl-N-(furan-3-ylmethyl)-4-methyl-1H-pyrazol-3-amine (CID 115735786) is 5-ethyl-N-(furan-3-ylmethyl)-4-methyl-1H-pyrazol-3-amine.
What is the SMILES notation for 5-ethyl-N-(furan-3-ylmethyl)-4-methyl-1H-pyrazol-3-amine?
The canonical SMILES for 5-ethyl-N-(furan-3-ylmethyl)-4-methyl-1H-pyrazol-3-amine is CCc1[nH]nc(NCc2ccoc2)c1C.
What is the InChIKey of 5-ethyl-N-(furan-3-ylmethyl)-4-methyl-1H-pyrazol-3-amine?
The InChIKey is ZFAMPLJLWZAJHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O/c1-3-10-8(2)11(14-13-10)12-6-9-4-5-15-7-9/h4-5,7H,3,6H2,1-2H3,(H2,12,13,14).
What are the key properties of 5-ethyl-N-(furan-3-ylmethyl)-4-methyl-1H-pyrazol-3-amine?
5-ethyl-N-(furan-3-ylmethyl)-4-methyl-1H-pyrazol-3-amine has a molecular weight of 205.26 g/mol, XLogP of 2.49, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-N-(furan-3-ylmethyl)-4-methyl-1H-pyrazol-3-amine is sourced from PubChem (CID 115735786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).