1-(2-piperidin-1-ylethyl)pyrazol-4-amine;hydrochloride

C10H19ClN4 — CID 71758026

IUPAC1-(2-piperidin-1-ylethyl)pyrazol-4-amine;hydrochloride
SMILESCl.Nc1cnn(CCN2CCCCC2)c1
InChIInChI=1S/C10H18N4.ClH/c11-10-8-12-14(9-10)7-6-13-4-2-1-3-5-13;/h8-9H,1-7,11H2;1H
InChIKeyXZWKCTJQLHQSLY-UHFFFAOYSA-N
MW230.74 g/mol
LogP1.37
Rot. Bonds3

About 1-(2-piperidin-1-ylethyl)pyrazol-4-amine;hydrochloride

1-(2-piperidin-1-ylethyl)pyrazol-4-amine;hydrochloride (PubChem CID 71758026) has the molecular formula C10H19ClN4 and a molecular weight of 230.74 g/mol. Its IUPAC name is 1-(2-piperidin-1-ylethyl)pyrazol-4-amine;hydrochloride.

Molecular Properties

Compound Name1-(2-piperidin-1-ylethyl)pyrazol-4-amine;hydrochloride
PubChem CID71758026
Molecular FormulaC10H19ClN4
Molecular Weight230.74 g/mol
Exact Mass230.13
IUPAC Name1-(2-piperidin-1-ylethyl)pyrazol-4-amine;hydrochloride
SMILESCl.Nc1cnn(CCN2CCCCC2)c1
InChIInChI=1S/C10H18N4.ClH/c11-10-8-12-14(9-10)7-6-13-4-2-1-3-5-13;/h8-9H,1-7,11H2;1H
InChIKeyXZWKCTJQLHQSLY-UHFFFAOYSA-N
XLogP1.37
TPSA47.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.74
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(2-piperidin-1-ylethyl)pyrazol-4-amine;hydrochloride?
The IUPAC name of 1-(2-piperidin-1-ylethyl)pyrazol-4-amine;hydrochloride (CID 71758026) is 1-(2-piperidin-1-ylethyl)pyrazol-4-amine;hydrochloride.
What is the SMILES notation for 1-(2-piperidin-1-ylethyl)pyrazol-4-amine;hydrochloride?
The canonical SMILES for 1-(2-piperidin-1-ylethyl)pyrazol-4-amine;hydrochloride is Cl.Nc1cnn(CCN2CCCCC2)c1.
What is the InChIKey of 1-(2-piperidin-1-ylethyl)pyrazol-4-amine;hydrochloride?
The InChIKey is XZWKCTJQLHQSLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4.ClH/c11-10-8-12-14(9-10)7-6-13-4-2-1-3-5-13;/h8-9H,1-7,11H2;1H.
What are the key properties of 1-(2-piperidin-1-ylethyl)pyrazol-4-amine;hydrochloride?
1-(2-piperidin-1-ylethyl)pyrazol-4-amine;hydrochloride has a molecular weight of 230.74 g/mol, XLogP of 1.37, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-piperidin-1-ylethyl)pyrazol-4-amine;hydrochloride is sourced from PubChem (CID 71758026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).