2-(3-cyclopropylpyrazol-1-yl)ethanamine;hydrochloride

C8H14ClN3 — CID 45156289

IUPAC2-(3-cyclopropylpyrazol-1-yl)ethanamine;hydrochloride
SMILESCl.NCCn1ccc(C2CC2)n1
InChIInChI=1S/C8H13N3.ClH/c9-4-6-11-5-3-8(10-11)7-1-2-7;/h3,5,7H,1-2,4,6,9H2;1H
InChIKeyJLQNEWDVEKQCCY-UHFFFAOYSA-N
MW187.67 g/mol
LogP1.14
Rot. Bonds3

About 2-(3-cyclopropylpyrazol-1-yl)ethanamine;hydrochloride

2-(3-cyclopropylpyrazol-1-yl)ethanamine;hydrochloride (PubChem CID 45156289) has the molecular formula C8H14ClN3 and a molecular weight of 187.67 g/mol. Its IUPAC name is 2-(3-cyclopropylpyrazol-1-yl)ethanamine;hydrochloride.

Molecular Properties

Compound Name2-(3-cyclopropylpyrazol-1-yl)ethanamine;hydrochloride
PubChem CID45156289
Molecular FormulaC8H14ClN3
Molecular Weight187.67 g/mol
Exact Mass187.09
IUPAC Name2-(3-cyclopropylpyrazol-1-yl)ethanamine;hydrochloride
SMILESCl.NCCn1ccc(C2CC2)n1
InChIInChI=1S/C8H13N3.ClH/c9-4-6-11-5-3-8(10-11)7-1-2-7;/h3,5,7H,1-2,4,6,9H2;1H
InChIKeyJLQNEWDVEKQCCY-UHFFFAOYSA-N
XLogP1.14
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.67
LogP ≤ 51.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(3-cyclopropylpyrazol-1-yl)ethanamine;hydrochloride?
The IUPAC name of 2-(3-cyclopropylpyrazol-1-yl)ethanamine;hydrochloride (CID 45156289) is 2-(3-cyclopropylpyrazol-1-yl)ethanamine;hydrochloride.
What is the SMILES notation for 2-(3-cyclopropylpyrazol-1-yl)ethanamine;hydrochloride?
The canonical SMILES for 2-(3-cyclopropylpyrazol-1-yl)ethanamine;hydrochloride is Cl.NCCn1ccc(C2CC2)n1.
What is the InChIKey of 2-(3-cyclopropylpyrazol-1-yl)ethanamine;hydrochloride?
The InChIKey is JLQNEWDVEKQCCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3.ClH/c9-4-6-11-5-3-8(10-11)7-1-2-7;/h3,5,7H,1-2,4,6,9H2;1H.
What are the key properties of 2-(3-cyclopropylpyrazol-1-yl)ethanamine;hydrochloride?
2-(3-cyclopropylpyrazol-1-yl)ethanamine;hydrochloride has a molecular weight of 187.67 g/mol, XLogP of 1.14, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-cyclopropylpyrazol-1-yl)ethanamine;hydrochloride is sourced from PubChem (CID 45156289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).