6-piperidin-4-yloxy-N,N-bis(prop-2-enyl)hexan-1-amine

C17H32N2O — CID 22279339

IUPAC6-piperidin-4-yloxy-N,N-bis(prop-2-enyl)hexan-1-amine
SMILESC=CCN(CC=C)CCCCCCOC1CCNCC1
InChIInChI=1S/C17H32N2O/c1-3-13-19(14-4-2)15-7-5-6-8-16-20-17-9-11-18-12-10-17/h3-4,17-18H,1-2,5-16H2
InChIKeyKXRKLXMVRKOVCX-UHFFFAOYSA-N
MW280.46 g/mol
LogP2.99
Rot. Bonds12

About 6-piperidin-4-yloxy-N,N-bis(prop-2-enyl)hexan-1-amine

6-piperidin-4-yloxy-N,N-bis(prop-2-enyl)hexan-1-amine (PubChem CID 22279339) has the molecular formula C17H32N2O and a molecular weight of 280.46 g/mol. Its IUPAC name is 6-piperidin-4-yloxy-N,N-bis(prop-2-enyl)hexan-1-amine.

Molecular Properties

Compound Name6-piperidin-4-yloxy-N,N-bis(prop-2-enyl)hexan-1-amine
PubChem CID22279339
Molecular FormulaC17H32N2O
Molecular Weight280.46 g/mol
Exact Mass280.25
IUPAC Name6-piperidin-4-yloxy-N,N-bis(prop-2-enyl)hexan-1-amine
SMILESC=CCN(CC=C)CCCCCCOC1CCNCC1
InChIInChI=1S/C17H32N2O/c1-3-13-19(14-4-2)15-7-5-6-8-16-20-17-9-11-18-12-10-17/h3-4,17-18H,1-2,5-16H2
InChIKeyKXRKLXMVRKOVCX-UHFFFAOYSA-N
XLogP2.99
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds12
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.46
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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 6-piperidin-4-yloxy-N,N-bis(prop-2-enyl)hexan-1-amine?
The IUPAC name of 6-piperidin-4-yloxy-N,N-bis(prop-2-enyl)hexan-1-amine (CID 22279339) is 6-piperidin-4-yloxy-N,N-bis(prop-2-enyl)hexan-1-amine.
What is the SMILES notation for 6-piperidin-4-yloxy-N,N-bis(prop-2-enyl)hexan-1-amine?
The canonical SMILES for 6-piperidin-4-yloxy-N,N-bis(prop-2-enyl)hexan-1-amine is C=CCN(CC=C)CCCCCCOC1CCNCC1.
What is the InChIKey of 6-piperidin-4-yloxy-N,N-bis(prop-2-enyl)hexan-1-amine?
The InChIKey is KXRKLXMVRKOVCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32N2O/c1-3-13-19(14-4-2)15-7-5-6-8-16-20-17-9-11-18-12-10-17/h3-4,17-18H,1-2,5-16H2.
What are the key properties of 6-piperidin-4-yloxy-N,N-bis(prop-2-enyl)hexan-1-amine?
6-piperidin-4-yloxy-N,N-bis(prop-2-enyl)hexan-1-amine has a molecular weight of 280.46 g/mol, XLogP of 2.99, 12 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-piperidin-4-yloxy-N,N-bis(prop-2-enyl)hexan-1-amine is sourced from PubChem (CID 22279339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).