1-[2-(cyclopenten-1-yl)ethyl]-N,2-dimethylpiperidin-4-amine

C14H26N2 — CID 106172504

IUPAC1-[2-(cyclopenten-1-yl)ethyl]-N,2-dimethylpiperidin-4-amine
SMILESCNC1CCN(CCC2=CCCC2)C(C)C1
InChIInChI=1S/C14H26N2/c1-12-11-14(15-2)8-10-16(12)9-7-13-5-3-4-6-13/h5,12,14-15H,3-4,6-11H2,1-2H3
InChIKeyQSAZXFNIEGVGIK-UHFFFAOYSA-N
MW222.38 g/mol
LogP2.56
Rot. Bonds4

About 1-[2-(cyclopenten-1-yl)ethyl]-N,2-dimethylpiperidin-4-amine

1-[2-(cyclopenten-1-yl)ethyl]-N,2-dimethylpiperidin-4-amine (PubChem CID 106172504) has the molecular formula C14H26N2 and a molecular weight of 222.38 g/mol. Its IUPAC name is 1-[2-(cyclopenten-1-yl)ethyl]-N,2-dimethylpiperidin-4-amine.

Molecular Properties

Compound Name1-[2-(cyclopenten-1-yl)ethyl]-N,2-dimethylpiperidin-4-amine
PubChem CID106172504
Molecular FormulaC14H26N2
Molecular Weight222.38 g/mol
Exact Mass222.21
IUPAC Name1-[2-(cyclopenten-1-yl)ethyl]-N,2-dimethylpiperidin-4-amine
SMILESCNC1CCN(CCC2=CCCC2)C(C)C1
InChIInChI=1S/C14H26N2/c1-12-11-14(15-2)8-10-16(12)9-7-13-5-3-4-6-13/h5,12,14-15H,3-4,6-11H2,1-2H3
InChIKeyQSAZXFNIEGVGIK-UHFFFAOYSA-N
XLogP2.56
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.38
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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 1-[2-(cyclopenten-1-yl)ethyl]-N,2-dimethylpiperidin-4-amine?
The IUPAC name of 1-[2-(cyclopenten-1-yl)ethyl]-N,2-dimethylpiperidin-4-amine (CID 106172504) is 1-[2-(cyclopenten-1-yl)ethyl]-N,2-dimethylpiperidin-4-amine.
What is the SMILES notation for 1-[2-(cyclopenten-1-yl)ethyl]-N,2-dimethylpiperidin-4-amine?
The canonical SMILES for 1-[2-(cyclopenten-1-yl)ethyl]-N,2-dimethylpiperidin-4-amine is CNC1CCN(CCC2=CCCC2)C(C)C1.
What is the InChIKey of 1-[2-(cyclopenten-1-yl)ethyl]-N,2-dimethylpiperidin-4-amine?
The InChIKey is QSAZXFNIEGVGIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2/c1-12-11-14(15-2)8-10-16(12)9-7-13-5-3-4-6-13/h5,12,14-15H,3-4,6-11H2,1-2H3.
What are the key properties of 1-[2-(cyclopenten-1-yl)ethyl]-N,2-dimethylpiperidin-4-amine?
1-[2-(cyclopenten-1-yl)ethyl]-N,2-dimethylpiperidin-4-amine has a molecular weight of 222.38 g/mol, XLogP of 2.56, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(cyclopenten-1-yl)ethyl]-N,2-dimethylpiperidin-4-amine is sourced from PubChem (CID 106172504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).