(1S)-cyclopent-2-en-1-amine;hydrochloride

C5H10ClN — CID 154832487

IUPAC(1S)-cyclopent-2-en-1-amine;hydrochloride
SMILESCl.N[C@@H]1C=CCC1
InChIInChI=1S/C5H9N.ClH/c6-5-3-1-2-4-5;/h1,3,5H,2,4,6H2;1H/t5-;/m1./s1
InChIKeyJDJUBQDUEVSVNI-NUBCRITNSA-N
MW119.59 g/mol
LogP1.09
Rot. Bonds

About (1S)-cyclopent-2-en-1-amine;hydrochloride

(1S)-cyclopent-2-en-1-amine;hydrochloride (PubChem CID 154832487) has the molecular formula C5H10ClN and a molecular weight of 119.59 g/mol. Its IUPAC name is (1S)-cyclopent-2-en-1-amine;hydrochloride.

Molecular Properties

Compound Name(1S)-cyclopent-2-en-1-amine;hydrochloride
PubChem CID154832487
Molecular FormulaC5H10ClN
Molecular Weight119.59 g/mol
Exact Mass119.05
IUPAC Name(1S)-cyclopent-2-en-1-amine;hydrochloride
SMILESCl.N[C@@H]1C=CCC1
InChIInChI=1S/C5H9N.ClH/c6-5-3-1-2-4-5;/h1,3,5H,2,4,6H2;1H/t5-;/m1./s1
InChIKeyJDJUBQDUEVSVNI-NUBCRITNSA-N
XLogP1.09
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms7
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500119.59
LogP ≤ 51.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (1S)-cyclopent-2-en-1-amine;hydrochloride?
The IUPAC name of (1S)-cyclopent-2-en-1-amine;hydrochloride (CID 154832487) is (1S)-cyclopent-2-en-1-amine;hydrochloride.
What is the SMILES notation for (1S)-cyclopent-2-en-1-amine;hydrochloride?
The canonical SMILES for (1S)-cyclopent-2-en-1-amine;hydrochloride is Cl.N[C@@H]1C=CCC1.
What is the InChIKey of (1S)-cyclopent-2-en-1-amine;hydrochloride?
The InChIKey is JDJUBQDUEVSVNI-NUBCRITNSA-N. The full InChI is InChI=1S/C5H9N.ClH/c6-5-3-1-2-4-5;/h1,3,5H,2,4,6H2;1H/t5-;/m1./s1.
What are the key properties of (1S)-cyclopent-2-en-1-amine;hydrochloride?
(1S)-cyclopent-2-en-1-amine;hydrochloride has a molecular weight of 119.59 g/mol, XLogP of 1.09, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-cyclopent-2-en-1-amine;hydrochloride is sourced from PubChem (CID 154832487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).