3-(ethylaminomethyl)-1-methylpyrazol-4-amine

C7H14N4 — CID 67760121

IUPAC3-(ethylaminomethyl)-1-methylpyrazol-4-amine
SMILESCCNCc1nn(C)cc1N
InChIInChI=1S/C7H14N4/c1-3-9-4-7-6(8)5-11(2)10-7/h5,9H,3-4,8H2,1-2H3
InChIKeyBUIVDRLHAARUOK-UHFFFAOYSA-N
MW154.22 g/mol
LogP0.11
Rot. Bonds3

About 3-(ethylaminomethyl)-1-methylpyrazol-4-amine

3-(ethylaminomethyl)-1-methylpyrazol-4-amine (PubChem CID 67760121) has the molecular formula C7H14N4 and a molecular weight of 154.22 g/mol. Its IUPAC name is 3-(ethylaminomethyl)-1-methylpyrazol-4-amine.

Molecular Properties

Compound Name3-(ethylaminomethyl)-1-methylpyrazol-4-amine
PubChem CID67760121
Molecular FormulaC7H14N4
Molecular Weight154.22 g/mol
Exact Mass154.12
IUPAC Name3-(ethylaminomethyl)-1-methylpyrazol-4-amine
SMILESCCNCc1nn(C)cc1N
InChIInChI=1S/C7H14N4/c1-3-9-4-7-6(8)5-11(2)10-7/h5,9H,3-4,8H2,1-2H3
InChIKeyBUIVDRLHAARUOK-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 3-(ethylaminomethyl)-1-methylpyrazol-4-amine?
The IUPAC name of 3-(ethylaminomethyl)-1-methylpyrazol-4-amine (CID 67760121) is 3-(ethylaminomethyl)-1-methylpyrazol-4-amine.
What is the SMILES notation for 3-(ethylaminomethyl)-1-methylpyrazol-4-amine?
The canonical SMILES for 3-(ethylaminomethyl)-1-methylpyrazol-4-amine is CCNCc1nn(C)cc1N.
What is the InChIKey of 3-(ethylaminomethyl)-1-methylpyrazol-4-amine?
The InChIKey is BUIVDRLHAARUOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N4/c1-3-9-4-7-6(8)5-11(2)10-7/h5,9H,3-4,8H2,1-2H3.
What are the key properties of 3-(ethylaminomethyl)-1-methylpyrazol-4-amine?
3-(ethylaminomethyl)-1-methylpyrazol-4-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 3-(ethylaminomethyl)-1-methylpyrazol-4-amine is sourced from PubChem (CID 67760121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).