N-ethylpyrazol-1-amine

C5H9N3 — CID 15129838

IUPACN-ethylpyrazol-1-amine
SMILESCCNn1cccn1
InChIInChI=1S/C5H9N3/c1-2-6-8-5-3-4-7-8/h3-6H,2H2,1H3
InChIKeyRMFCYWTWVABZJH-UHFFFAOYSA-N
MW111.15 g/mol
LogP0.45
Rot. Bonds2

About N-ethylpyrazol-1-amine

N-ethylpyrazol-1-amine (PubChem CID 15129838) has the molecular formula C5H9N3 and a molecular weight of 111.15 g/mol. Its IUPAC name is N-ethylpyrazol-1-amine.

Molecular Properties

Compound NameN-ethylpyrazol-1-amine
PubChem CID15129838
Molecular FormulaC5H9N3
Molecular Weight111.15 g/mol
Exact Mass111.08
IUPAC NameN-ethylpyrazol-1-amine
SMILESCCNn1cccn1
InChIInChI=1S/C5H9N3/c1-2-6-8-5-3-4-7-8/h3-6H,2H2,1H3
InChIKeyRMFCYWTWVABZJH-UHFFFAOYSA-N
XLogP0.45
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500111.15
LogP ≤ 50.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

Pyrazole
CID 1048
3-Iodo-1H-pyrazole
CID 1239830
1H-pyrazol-1-amine
CID 11829352
3-fluoro-1H-pyrazole
CID 15055508
1H-Pyrazole, hydrochloride (1:1)
CID 190350
Pyrazolium
CID 3416953
Trimethylsilylpyrazole
CID 580566
1-(Tributylstannyl)-1H-pyrazole
CID 305933
Pyrazole-d4
CID 71309634
Pyrazolium chloride
CID 67909939
1-Deuteriopyrazole
CID 12262518
4-Deuteropyrazole
CID 13971148

Frequently Asked Questions

What is the IUPAC name of N-ethylpyrazol-1-amine?
The IUPAC name of N-ethylpyrazol-1-amine (CID 15129838) is N-ethylpyrazol-1-amine.
What is the SMILES notation for N-ethylpyrazol-1-amine?
The canonical SMILES for N-ethylpyrazol-1-amine is CCNn1cccn1.
What is the InChIKey of N-ethylpyrazol-1-amine?
The InChIKey is RMFCYWTWVABZJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9N3/c1-2-6-8-5-3-4-7-8/h3-6H,2H2,1H3.
What are the key properties of N-ethylpyrazol-1-amine?
N-ethylpyrazol-1-amine has a molecular weight of 111.15 g/mol, XLogP of 0.45, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethylpyrazol-1-amine is sourced from PubChem (CID 15129838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).