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

C7H14N4 — CID 117217177

IUPAC5-(ethylaminomethyl)-1-methylpyrazol-3-amine
SMILESCCNCc1cc(N)nn1C
InChIInChI=1S/C7H14N4/c1-3-9-5-6-4-7(8)10-11(6)2/h4,9H,3,5H2,1-2H3,(H2,8,10)
InChIKeyHPASAWCFDGKUFX-UHFFFAOYSA-N
MW154.22 g/mol
LogP0.11
Rot. Bonds3

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

5-(ethylaminomethyl)-1-methylpyrazol-3-amine (PubChem CID 117217177) has the molecular formula C7H14N4 and a molecular weight of 154.22 g/mol. Its IUPAC name is 5-(ethylaminomethyl)-1-methylpyrazol-3-amine.

Molecular Properties

Compound Name5-(ethylaminomethyl)-1-methylpyrazol-3-amine
PubChem CID117217177
Molecular FormulaC7H14N4
Molecular Weight154.22 g/mol
Exact Mass154.12
IUPAC Name5-(ethylaminomethyl)-1-methylpyrazol-3-amine
SMILESCCNCc1cc(N)nn1C
InChIInChI=1S/C7H14N4/c1-3-9-5-6-4-7(8)10-11(6)2/h4,9H,3,5H2,1-2H3,(H2,8,10)
InChIKeyHPASAWCFDGKUFX-UHFFFAOYSA-N
XLogP0.11
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.22
LogP ≤ 50.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(ethylaminomethyl)-1-methylpyrazol-3-amine?
The IUPAC name of 5-(ethylaminomethyl)-1-methylpyrazol-3-amine (CID 117217177) is 5-(ethylaminomethyl)-1-methylpyrazol-3-amine.
What is the SMILES notation for 5-(ethylaminomethyl)-1-methylpyrazol-3-amine?
The canonical SMILES for 5-(ethylaminomethyl)-1-methylpyrazol-3-amine is CCNCc1cc(N)nn1C.
What is the InChIKey of 5-(ethylaminomethyl)-1-methylpyrazol-3-amine?
The InChIKey is HPASAWCFDGKUFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N4/c1-3-9-5-6-4-7(8)10-11(6)2/h4,9H,3,5H2,1-2H3,(H2,8,10).
What are the key properties of 5-(ethylaminomethyl)-1-methylpyrazol-3-amine?
5-(ethylaminomethyl)-1-methylpyrazol-3-amine has a molecular weight of 154.22 g/mol, XLogP of 0.11, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(ethylaminomethyl)-1-methylpyrazol-3-amine is sourced from PubChem (CID 117217177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).