1-(4-cyclopentyl-1-methylpyrazol-3-yl)ethanamine

C11H19N3 — CID 105422890

IUPAC1-(4-cyclopentyl-1-methylpyrazol-3-yl)ethanamine
SMILESCC(N)c1nn(C)cc1C1CCCC1
InChIInChI=1S/C11H19N3/c1-8(12)11-10(7-14(2)13-11)9-5-3-4-6-9/h7-9H,3-6,12H2,1-2H3
InChIKeyTYNNCPZVODLGPO-UHFFFAOYSA-N
MW193.29 g/mol
LogP2.10
Rot. Bonds2

About 1-(4-cyclopentyl-1-methylpyrazol-3-yl)ethanamine

1-(4-cyclopentyl-1-methylpyrazol-3-yl)ethanamine (PubChem CID 105422890) has the molecular formula C11H19N3 and a molecular weight of 193.29 g/mol. Its IUPAC name is 1-(4-cyclopentyl-1-methylpyrazol-3-yl)ethanamine.

Molecular Properties

Compound Name1-(4-cyclopentyl-1-methylpyrazol-3-yl)ethanamine
PubChem CID105422890
Molecular FormulaC11H19N3
Molecular Weight193.29 g/mol
Exact Mass193.16
IUPAC Name1-(4-cyclopentyl-1-methylpyrazol-3-yl)ethanamine
SMILESCC(N)c1nn(C)cc1C1CCCC1
InChIInChI=1S/C11H19N3/c1-8(12)11-10(7-14(2)13-11)9-5-3-4-6-9/h7-9H,3-6,12H2,1-2H3
InChIKeyTYNNCPZVODLGPO-UHFFFAOYSA-N
XLogP2.10
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(4-cyclopentyl-1-methylpyrazol-3-yl)ethanamine?
The IUPAC name of 1-(4-cyclopentyl-1-methylpyrazol-3-yl)ethanamine (CID 105422890) is 1-(4-cyclopentyl-1-methylpyrazol-3-yl)ethanamine.
What is the SMILES notation for 1-(4-cyclopentyl-1-methylpyrazol-3-yl)ethanamine?
The canonical SMILES for 1-(4-cyclopentyl-1-methylpyrazol-3-yl)ethanamine is CC(N)c1nn(C)cc1C1CCCC1.
What is the InChIKey of 1-(4-cyclopentyl-1-methylpyrazol-3-yl)ethanamine?
The InChIKey is TYNNCPZVODLGPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3/c1-8(12)11-10(7-14(2)13-11)9-5-3-4-6-9/h7-9H,3-6,12H2,1-2H3.
What are the key properties of 1-(4-cyclopentyl-1-methylpyrazol-3-yl)ethanamine?
1-(4-cyclopentyl-1-methylpyrazol-3-yl)ethanamine has a molecular weight of 193.29 g/mol, XLogP of 2.10, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-cyclopentyl-1-methylpyrazol-3-yl)ethanamine is sourced from PubChem (CID 105422890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).