N-pent-4-enylpiperidin-1-amine

C10H20N2 — CID 83014277

IUPACN-pent-4-enylpiperidin-1-amine
SMILESC=CCCCNN1CCCCC1
InChIInChI=1S/C10H20N2/c1-2-3-5-8-11-12-9-6-4-7-10-12/h2,11H,1,3-10H2
InChIKeyYDRJRQMNDYZPSX-UHFFFAOYSA-N
MW168.28 g/mol
LogP1.94
Rot. Bonds5

About N-pent-4-enylpiperidin-1-amine

N-pent-4-enylpiperidin-1-amine (PubChem CID 83014277) has the molecular formula C10H20N2 and a molecular weight of 168.28 g/mol. Its IUPAC name is N-pent-4-enylpiperidin-1-amine.

Molecular Properties

Compound NameN-pent-4-enylpiperidin-1-amine
PubChem CID83014277
Molecular FormulaC10H20N2
Molecular Weight168.28 g/mol
Exact Mass168.16
IUPAC NameN-pent-4-enylpiperidin-1-amine
SMILESC=CCCCNN1CCCCC1
InChIInChI=1S/C10H20N2/c1-2-3-5-8-11-12-9-6-4-7-10-12/h2,11H,1,3-10H2
InChIKeyYDRJRQMNDYZPSX-UHFFFAOYSA-N
XLogP1.94
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.28
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-pent-4-enylpiperidin-1-amine?
The IUPAC name of N-pent-4-enylpiperidin-1-amine (CID 83014277) is N-pent-4-enylpiperidin-1-amine.
What is the SMILES notation for N-pent-4-enylpiperidin-1-amine?
The canonical SMILES for N-pent-4-enylpiperidin-1-amine is C=CCCCNN1CCCCC1.
What is the InChIKey of N-pent-4-enylpiperidin-1-amine?
The InChIKey is YDRJRQMNDYZPSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2/c1-2-3-5-8-11-12-9-6-4-7-10-12/h2,11H,1,3-10H2.
What are the key properties of N-pent-4-enylpiperidin-1-amine?
N-pent-4-enylpiperidin-1-amine has a molecular weight of 168.28 g/mol, XLogP of 1.94, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-pent-4-enylpiperidin-1-amine is sourced from PubChem (CID 83014277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).