1-[(2Z)-2-[(Z)-1-aminoprop-1-enyl]iminoethyl]-N,N-dimethylpiperidin-4-amine

C12H24N4 — CID 143829598

IUPAC1-[(2Z)-2-[(Z)-1-aminoprop-1-enyl]iminoethyl]-N,N-dimethylpiperidin-4-amine
SMILESC/C=C(N)\N=C/CN1CCC(N(C)C)CC1
InChIInChI=1S/C12H24N4/c1-4-12(13)14-7-10-16-8-5-11(6-9-16)15(2)3/h4,7,11H,5-6,8-10,13H2,1-3H3/b12-4-,14-7-
InChIKeyGUONGKLGMXXTOR-ATRDEXMTSA-N
MW224.35 g/mol
LogP0.90
Rot. Bonds4

About 1-[(2Z)-2-[(Z)-1-aminoprop-1-enyl]iminoethyl]-N,N-dimethylpiperidin-4-amine

1-[(2Z)-2-[(Z)-1-aminoprop-1-enyl]iminoethyl]-N,N-dimethylpiperidin-4-amine (PubChem CID 143829598) has the molecular formula C12H24N4 and a molecular weight of 224.35 g/mol. Its IUPAC name is 1-[(2Z)-2-[(Z)-1-aminoprop-1-enyl]iminoethyl]-N,N-dimethylpiperidin-4-amine.

Molecular Properties

Compound Name1-[(2Z)-2-[(Z)-1-aminoprop-1-enyl]iminoethyl]-N,N-dimethylpiperidin-4-amine
PubChem CID143829598
Molecular FormulaC12H24N4
Molecular Weight224.35 g/mol
Exact Mass224.20
IUPAC Name1-[(2Z)-2-[(Z)-1-aminoprop-1-enyl]iminoethyl]-N,N-dimethylpiperidin-4-amine
SMILESC/C=C(N)\N=C/CN1CCC(N(C)C)CC1
InChIInChI=1S/C12H24N4/c1-4-12(13)14-7-10-16-8-5-11(6-9-16)15(2)3/h4,7,11H,5-6,8-10,13H2,1-3H3/b12-4-,14-7-
InChIKeyGUONGKLGMXXTOR-ATRDEXMTSA-N
XLogP0.90
TPSA44.86 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.35
LogP ≤ 50.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-[(2Z)-2-[(Z)-1-aminoprop-1-enyl]iminoethyl]-N,N-dimethylpiperidin-4-amine?
The IUPAC name of 1-[(2Z)-2-[(Z)-1-aminoprop-1-enyl]iminoethyl]-N,N-dimethylpiperidin-4-amine (CID 143829598) is 1-[(2Z)-2-[(Z)-1-aminoprop-1-enyl]iminoethyl]-N,N-dimethylpiperidin-4-amine.
What is the SMILES notation for 1-[(2Z)-2-[(Z)-1-aminoprop-1-enyl]iminoethyl]-N,N-dimethylpiperidin-4-amine?
The canonical SMILES for 1-[(2Z)-2-[(Z)-1-aminoprop-1-enyl]iminoethyl]-N,N-dimethylpiperidin-4-amine is C/C=C(N)\N=C/CN1CCC(N(C)C)CC1.
What is the InChIKey of 1-[(2Z)-2-[(Z)-1-aminoprop-1-enyl]iminoethyl]-N,N-dimethylpiperidin-4-amine?
The InChIKey is GUONGKLGMXXTOR-ATRDEXMTSA-N. The full InChI is InChI=1S/C12H24N4/c1-4-12(13)14-7-10-16-8-5-11(6-9-16)15(2)3/h4,7,11H,5-6,8-10,13H2,1-3H3/b12-4-,14-7-.
What are the key properties of 1-[(2Z)-2-[(Z)-1-aminoprop-1-enyl]iminoethyl]-N,N-dimethylpiperidin-4-amine?
1-[(2Z)-2-[(Z)-1-aminoprop-1-enyl]iminoethyl]-N,N-dimethylpiperidin-4-amine has a molecular weight of 224.35 g/mol, XLogP of 0.90, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2Z)-2-[(Z)-1-aminoprop-1-enyl]iminoethyl]-N,N-dimethylpiperidin-4-amine is sourced from PubChem (CID 143829598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).