N-ethyl-1H-pyrazol-5-amine

C5H9N3 — CID 14818493

IUPACN-ethyl-1H-pyrazol-5-amine
SMILESCCNc1ccn[nH]1
InChIInChI=1S/C5H9N3/c1-2-6-5-3-4-7-8-5/h3-4H,2H2,1H3,(H2,6,7,8)
InChIKeyFVSRJWMYUVOQNY-UHFFFAOYSA-N
MW111.15 g/mol
LogP0.84
Rot. Bonds2

About N-ethyl-1H-pyrazol-5-amine

N-ethyl-1H-pyrazol-5-amine (PubChem CID 14818493) has the molecular formula C5H9N3 and a molecular weight of 111.15 g/mol. Its IUPAC name is N-ethyl-1H-pyrazol-5-amine.

Molecular Properties

Compound NameN-ethyl-1H-pyrazol-5-amine
PubChem CID14818493
Molecular FormulaC5H9N3
Molecular Weight111.15 g/mol
Exact Mass111.08
IUPAC NameN-ethyl-1H-pyrazol-5-amine
SMILESCCNc1ccn[nH]1
InChIInChI=1S/C5H9N3/c1-2-6-5-3-4-7-8-5/h3-4H,2H2,1H3,(H2,6,7,8)
InChIKeyFVSRJWMYUVOQNY-UHFFFAOYSA-N
XLogP0.84
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500111.15
LogP ≤ 50.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-1H-pyrazol-5-amine?
The IUPAC name of N-ethyl-1H-pyrazol-5-amine (CID 14818493) is N-ethyl-1H-pyrazol-5-amine.
What is the SMILES notation for N-ethyl-1H-pyrazol-5-amine?
The canonical SMILES for N-ethyl-1H-pyrazol-5-amine is CCNc1ccn[nH]1.
What is the InChIKey of N-ethyl-1H-pyrazol-5-amine?
The InChIKey is FVSRJWMYUVOQNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9N3/c1-2-6-5-3-4-7-8-5/h3-4H,2H2,1H3,(H2,6,7,8).
What are the key properties of N-ethyl-1H-pyrazol-5-amine?
N-ethyl-1H-pyrazol-5-amine has a molecular weight of 111.15 g/mol, XLogP of 0.84, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1H-pyrazol-5-amine is sourced from PubChem (CID 14818493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).