ethane;4-methyl-1H-pyrazol-5-amine

C8H19N3 — CID 142845630

IUPACethane;4-methyl-1H-pyrazol-5-amine
SMILESCC.CC.Cc1cn[nH]c1N
InChIInChI=1S/C4H7N3.2C2H6/c1-3-2-6-7-4(3)5;2*1-2/h2H,1H3,(H3,5,6,7);2*1-2H3
InChIKeyVADBUWKZLKOLGS-UHFFFAOYSA-N
MW157.26 g/mol
LogP2.35
Rot. Bonds

About ethane;4-methyl-1H-pyrazol-5-amine

ethane;4-methyl-1H-pyrazol-5-amine (PubChem CID 142845630) has the molecular formula C8H19N3 and a molecular weight of 157.26 g/mol. Its IUPAC name is ethane;4-methyl-1H-pyrazol-5-amine.

Molecular Properties

Compound Nameethane;4-methyl-1H-pyrazol-5-amine
PubChem CID142845630
Molecular FormulaC8H19N3
Molecular Weight157.26 g/mol
Exact Mass157.16
IUPAC Nameethane;4-methyl-1H-pyrazol-5-amine
SMILESCC.CC.Cc1cn[nH]c1N
InChIInChI=1S/C4H7N3.2C2H6/c1-3-2-6-7-4(3)5;2*1-2/h2H,1H3,(H3,5,6,7);2*1-2H3
InChIKeyVADBUWKZLKOLGS-UHFFFAOYSA-N
XLogP2.35
TPSA54.70 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.26
LogP ≤ 52.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of ethane;4-methyl-1H-pyrazol-5-amine?
The IUPAC name of ethane;4-methyl-1H-pyrazol-5-amine (CID 142845630) is ethane;4-methyl-1H-pyrazol-5-amine.
What is the SMILES notation for ethane;4-methyl-1H-pyrazol-5-amine?
The canonical SMILES for ethane;4-methyl-1H-pyrazol-5-amine is CC.CC.Cc1cn[nH]c1N.
What is the InChIKey of ethane;4-methyl-1H-pyrazol-5-amine?
The InChIKey is VADBUWKZLKOLGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H7N3.2C2H6/c1-3-2-6-7-4(3)5;2*1-2/h2H,1H3,(H3,5,6,7);2*1-2H3.
What are the key properties of ethane;4-methyl-1H-pyrazol-5-amine?
ethane;4-methyl-1H-pyrazol-5-amine has a molecular weight of 157.26 g/mol, XLogP of 2.35, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;4-methyl-1H-pyrazol-5-amine is sourced from PubChem (CID 142845630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).