2-prop-2-enylpiperidin-1-amine

C8H16N2 — CID 67216893

IUPAC2-prop-2-enylpiperidin-1-amine
SMILESC=CCC1CCCCN1N
InChIInChI=1S/C8H16N2/c1-2-5-8-6-3-4-7-10(8)9/h2,8H,1,3-7,9H2
InChIKeyBMSVUMMSVQHJON-UHFFFAOYSA-N
MW140.23 g/mol
LogP1.29
Rot. Bonds2

About 2-prop-2-enylpiperidin-1-amine

2-prop-2-enylpiperidin-1-amine (PubChem CID 67216893) has the molecular formula C8H16N2 and a molecular weight of 140.23 g/mol. Its IUPAC name is 2-prop-2-enylpiperidin-1-amine.

Molecular Properties

Compound Name2-prop-2-enylpiperidin-1-amine
PubChem CID67216893
Molecular FormulaC8H16N2
Molecular Weight140.23 g/mol
Exact Mass140.13
IUPAC Name2-prop-2-enylpiperidin-1-amine
SMILESC=CCC1CCCCN1N
InChIInChI=1S/C8H16N2/c1-2-5-8-6-3-4-7-10(8)9/h2,8H,1,3-7,9H2
InChIKeyBMSVUMMSVQHJON-UHFFFAOYSA-N
XLogP1.29
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.23
LogP ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-prop-2-enylpiperidin-1-amine?
The IUPAC name of 2-prop-2-enylpiperidin-1-amine (CID 67216893) is 2-prop-2-enylpiperidin-1-amine.
What is the SMILES notation for 2-prop-2-enylpiperidin-1-amine?
The canonical SMILES for 2-prop-2-enylpiperidin-1-amine is C=CCC1CCCCN1N.
What is the InChIKey of 2-prop-2-enylpiperidin-1-amine?
The InChIKey is BMSVUMMSVQHJON-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2/c1-2-5-8-6-3-4-7-10(8)9/h2,8H,1,3-7,9H2.
What are the key properties of 2-prop-2-enylpiperidin-1-amine?
2-prop-2-enylpiperidin-1-amine has a molecular weight of 140.23 g/mol, XLogP of 1.29, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-prop-2-enylpiperidin-1-amine is sourced from PubChem (CID 67216893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).