1-(5-cyclopentyl-1-ethylpyrazol-3-yl)ethanamine

C12H21N3 — CID 105461050

IUPAC1-(5-cyclopentyl-1-ethylpyrazol-3-yl)ethanamine
SMILESCCn1nc(C(C)N)cc1C1CCCC1
InChIInChI=1S/C12H21N3/c1-3-15-12(10-6-4-5-7-10)8-11(14-15)9(2)13/h8-10H,3-7,13H2,1-2H3
InChIKeySLIOFLZEIHHYFX-UHFFFAOYSA-N
MW207.32 g/mol
LogP2.58
Rot. Bonds3

About 1-(5-cyclopentyl-1-ethylpyrazol-3-yl)ethanamine

1-(5-cyclopentyl-1-ethylpyrazol-3-yl)ethanamine (PubChem CID 105461050) has the molecular formula C12H21N3 and a molecular weight of 207.32 g/mol. Its IUPAC name is 1-(5-cyclopentyl-1-ethylpyrazol-3-yl)ethanamine.

Molecular Properties

Compound Name1-(5-cyclopentyl-1-ethylpyrazol-3-yl)ethanamine
PubChem CID105461050
Molecular FormulaC12H21N3
Molecular Weight207.32 g/mol
Exact Mass207.17
IUPAC Name1-(5-cyclopentyl-1-ethylpyrazol-3-yl)ethanamine
SMILESCCn1nc(C(C)N)cc1C1CCCC1
InChIInChI=1S/C12H21N3/c1-3-15-12(10-6-4-5-7-10)8-11(14-15)9(2)13/h8-10H,3-7,13H2,1-2H3
InChIKeySLIOFLZEIHHYFX-UHFFFAOYSA-N
XLogP2.58
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.32
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(5-cyclopentyl-1-ethylpyrazol-3-yl)ethanamine?
The IUPAC name of 1-(5-cyclopentyl-1-ethylpyrazol-3-yl)ethanamine (CID 105461050) is 1-(5-cyclopentyl-1-ethylpyrazol-3-yl)ethanamine.
What is the SMILES notation for 1-(5-cyclopentyl-1-ethylpyrazol-3-yl)ethanamine?
The canonical SMILES for 1-(5-cyclopentyl-1-ethylpyrazol-3-yl)ethanamine is CCn1nc(C(C)N)cc1C1CCCC1.
What is the InChIKey of 1-(5-cyclopentyl-1-ethylpyrazol-3-yl)ethanamine?
The InChIKey is SLIOFLZEIHHYFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3/c1-3-15-12(10-6-4-5-7-10)8-11(14-15)9(2)13/h8-10H,3-7,13H2,1-2H3.
What are the key properties of 1-(5-cyclopentyl-1-ethylpyrazol-3-yl)ethanamine?
1-(5-cyclopentyl-1-ethylpyrazol-3-yl)ethanamine has a molecular weight of 207.32 g/mol, XLogP of 2.58, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-cyclopentyl-1-ethylpyrazol-3-yl)ethanamine is sourced from PubChem (CID 105461050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).