4-ethyl-N,N,5-trimethyl-1H-pyrazol-3-amine

C8H15N3 — CID 146478393

IUPAC4-ethyl-N,N,5-trimethyl-1H-pyrazol-3-amine
SMILESCCc1c(N(C)C)n[nH]c1C
InChIInChI=1S/C8H15N3/c1-5-7-6(2)9-10-8(7)11(3)4/h5H2,1-4H3,(H,9,10)
InChIKeyHHKHKCXIMDSBPZ-UHFFFAOYSA-N
MW153.23 g/mol
LogP1.35
Rot. Bonds2

About 4-ethyl-N,N,5-trimethyl-1H-pyrazol-3-amine

4-ethyl-N,N,5-trimethyl-1H-pyrazol-3-amine (PubChem CID 146478393) has the molecular formula C8H15N3 and a molecular weight of 153.23 g/mol. Its IUPAC name is 4-ethyl-N,N,5-trimethyl-1H-pyrazol-3-amine.

Molecular Properties

Compound Name4-ethyl-N,N,5-trimethyl-1H-pyrazol-3-amine
PubChem CID146478393
Molecular FormulaC8H15N3
Molecular Weight153.23 g/mol
Exact Mass153.13
IUPAC Name4-ethyl-N,N,5-trimethyl-1H-pyrazol-3-amine
SMILESCCc1c(N(C)C)n[nH]c1C
InChIInChI=1S/C8H15N3/c1-5-7-6(2)9-10-8(7)11(3)4/h5H2,1-4H3,(H,9,10)
InChIKeyHHKHKCXIMDSBPZ-UHFFFAOYSA-N
XLogP1.35
TPSA31.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.23
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-ethyl-N,N,5-trimethyl-1H-pyrazol-3-amine?
The IUPAC name of 4-ethyl-N,N,5-trimethyl-1H-pyrazol-3-amine (CID 146478393) is 4-ethyl-N,N,5-trimethyl-1H-pyrazol-3-amine.
What is the SMILES notation for 4-ethyl-N,N,5-trimethyl-1H-pyrazol-3-amine?
The canonical SMILES for 4-ethyl-N,N,5-trimethyl-1H-pyrazol-3-amine is CCc1c(N(C)C)n[nH]c1C.
What is the InChIKey of 4-ethyl-N,N,5-trimethyl-1H-pyrazol-3-amine?
The InChIKey is HHKHKCXIMDSBPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N3/c1-5-7-6(2)9-10-8(7)11(3)4/h5H2,1-4H3,(H,9,10).
What are the key properties of 4-ethyl-N,N,5-trimethyl-1H-pyrazol-3-amine?
4-ethyl-N,N,5-trimethyl-1H-pyrazol-3-amine has a molecular weight of 153.23 g/mol, XLogP of 1.35, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-N,N,5-trimethyl-1H-pyrazol-3-amine is sourced from PubChem (CID 146478393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).