ethane;5-ethyl-4-[(Z)-prop-1-enyl]-1H-pyrazol-3-amine

C12H25N3 — CID 143701310

IUPACethane;5-ethyl-4-[(Z)-prop-1-enyl]-1H-pyrazol-3-amine
SMILESC/C=C\c1c(N)n[nH]c1CC.CC.CC
InChIInChI=1S/C8H13N3.2C2H6/c1-3-5-6-7(4-2)10-11-8(6)9;2*1-2/h3,5H,4H2,1-2H3,(H3,9,10,11);2*1-2H3/b5-3-;;
InChIKeyZHZPULIIHPUEOD-ORIPCLHRSA-N
MW211.35 g/mol
LogP3.64
Rot. Bonds2

About ethane;5-ethyl-4-[(Z)-prop-1-enyl]-1H-pyrazol-3-amine

ethane;5-ethyl-4-[(Z)-prop-1-enyl]-1H-pyrazol-3-amine (PubChem CID 143701310) has the molecular formula C12H25N3 and a molecular weight of 211.35 g/mol. Its IUPAC name is ethane;5-ethyl-4-[(Z)-prop-1-enyl]-1H-pyrazol-3-amine.

Molecular Properties

Compound Nameethane;5-ethyl-4-[(Z)-prop-1-enyl]-1H-pyrazol-3-amine
PubChem CID143701310
Molecular FormulaC12H25N3
Molecular Weight211.35 g/mol
Exact Mass211.20
IUPAC Nameethane;5-ethyl-4-[(Z)-prop-1-enyl]-1H-pyrazol-3-amine
SMILESC/C=C\c1c(N)n[nH]c1CC.CC.CC
InChIInChI=1S/C8H13N3.2C2H6/c1-3-5-6-7(4-2)10-11-8(6)9;2*1-2/h3,5H,4H2,1-2H3,(H3,9,10,11);2*1-2H3/b5-3-;;
InChIKeyZHZPULIIHPUEOD-ORIPCLHRSA-N
XLogP3.64
TPSA54.70 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.35
LogP ≤ 53.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze ethane;5-ethyl-4-[(Z)-prop-1-enyl]-1H-pyrazol-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of ethane;5-ethyl-4-[(Z)-prop-1-enyl]-1H-pyrazol-3-amine?
The IUPAC name of ethane;5-ethyl-4-[(Z)-prop-1-enyl]-1H-pyrazol-3-amine (CID 143701310) is ethane;5-ethyl-4-[(Z)-prop-1-enyl]-1H-pyrazol-3-amine.
What is the SMILES notation for ethane;5-ethyl-4-[(Z)-prop-1-enyl]-1H-pyrazol-3-amine?
The canonical SMILES for ethane;5-ethyl-4-[(Z)-prop-1-enyl]-1H-pyrazol-3-amine is C/C=C\c1c(N)n[nH]c1CC.CC.CC.
What is the InChIKey of ethane;5-ethyl-4-[(Z)-prop-1-enyl]-1H-pyrazol-3-amine?
The InChIKey is ZHZPULIIHPUEOD-ORIPCLHRSA-N. The full InChI is InChI=1S/C8H13N3.2C2H6/c1-3-5-6-7(4-2)10-11-8(6)9;2*1-2/h3,5H,4H2,1-2H3,(H3,9,10,11);2*1-2H3/b5-3-;;.
What are the key properties of ethane;5-ethyl-4-[(Z)-prop-1-enyl]-1H-pyrazol-3-amine?
ethane;5-ethyl-4-[(Z)-prop-1-enyl]-1H-pyrazol-3-amine has a molecular weight of 211.35 g/mol, XLogP of 3.64, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;5-ethyl-4-[(Z)-prop-1-enyl]-1H-pyrazol-3-amine is sourced from PubChem (CID 143701310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).