cyclopent-3-en-1-ylmethanamine;hydrochloride

C6H12ClN — CID 155011079

IUPACcyclopent-3-en-1-ylmethanamine;hydrochloride
SMILESCl.NCC1CC=CC1
InChIInChI=1S/C6H11N.ClH/c7-5-6-3-1-2-4-6;/h1-2,6H,3-5,7H2;1H
InChIKeyPNBVMWJKTWCORX-UHFFFAOYSA-N
MW133.62 g/mol
LogP1.33
Rot. Bonds1

About cyclopent-3-en-1-ylmethanamine;hydrochloride

cyclopent-3-en-1-ylmethanamine;hydrochloride (PubChem CID 155011079) has the molecular formula C6H12ClN and a molecular weight of 133.62 g/mol. Its IUPAC name is cyclopent-3-en-1-ylmethanamine;hydrochloride.

Molecular Properties

Compound Namecyclopent-3-en-1-ylmethanamine;hydrochloride
PubChem CID155011079
Molecular FormulaC6H12ClN
Molecular Weight133.62 g/mol
Exact Mass133.07
IUPAC Namecyclopent-3-en-1-ylmethanamine;hydrochloride
SMILESCl.NCC1CC=CC1
InChIInChI=1S/C6H11N.ClH/c7-5-6-3-1-2-4-6;/h1-2,6H,3-5,7H2;1H
InChIKeyPNBVMWJKTWCORX-UHFFFAOYSA-N
XLogP1.33
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500133.62
LogP ≤ 51.33
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 cyclopent-3-en-1-ylmethanamine;hydrochloride?
The IUPAC name of cyclopent-3-en-1-ylmethanamine;hydrochloride (CID 155011079) is cyclopent-3-en-1-ylmethanamine;hydrochloride.
What is the SMILES notation for cyclopent-3-en-1-ylmethanamine;hydrochloride?
The canonical SMILES for cyclopent-3-en-1-ylmethanamine;hydrochloride is Cl.NCC1CC=CC1.
What is the InChIKey of cyclopent-3-en-1-ylmethanamine;hydrochloride?
The InChIKey is PNBVMWJKTWCORX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N.ClH/c7-5-6-3-1-2-4-6;/h1-2,6H,3-5,7H2;1H.
What are the key properties of cyclopent-3-en-1-ylmethanamine;hydrochloride?
cyclopent-3-en-1-ylmethanamine;hydrochloride has a molecular weight of 133.62 g/mol, XLogP of 1.33, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopent-3-en-1-ylmethanamine;hydrochloride is sourced from PubChem (CID 155011079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).