1-(1-aminoethenyl)-4-methylpiperidin-4-amine

C8H17N3 — CID 166876536

IUPAC1-(1-aminoethenyl)-4-methylpiperidin-4-amine
SMILESC=C(N)N1CCC(C)(N)CC1
InChIInChI=1S/C8H17N3/c1-7(9)11-5-3-8(2,10)4-6-11/h1,3-6,9-10H2,2H3
InChIKeyBZHDJZAEVZRKSD-UHFFFAOYSA-N
MW155.24 g/mol
LogP0.23
Rot. Bonds1

About 1-(1-aminoethenyl)-4-methylpiperidin-4-amine

1-(1-aminoethenyl)-4-methylpiperidin-4-amine (PubChem CID 166876536) has the molecular formula C8H17N3 and a molecular weight of 155.24 g/mol. Its IUPAC name is 1-(1-aminoethenyl)-4-methylpiperidin-4-amine.

Molecular Properties

Compound Name1-(1-aminoethenyl)-4-methylpiperidin-4-amine
PubChem CID166876536
Molecular FormulaC8H17N3
Molecular Weight155.24 g/mol
Exact Mass155.14
IUPAC Name1-(1-aminoethenyl)-4-methylpiperidin-4-amine
SMILESC=C(N)N1CCC(C)(N)CC1
InChIInChI=1S/C8H17N3/c1-7(9)11-5-3-8(2,10)4-6-11/h1,3-6,9-10H2,2H3
InChIKeyBZHDJZAEVZRKSD-UHFFFAOYSA-N
XLogP0.23
TPSA55.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.24
LogP ≤ 50.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(1-aminoethenyl)-4-methylpiperidin-4-amine?
The IUPAC name of 1-(1-aminoethenyl)-4-methylpiperidin-4-amine (CID 166876536) is 1-(1-aminoethenyl)-4-methylpiperidin-4-amine.
What is the SMILES notation for 1-(1-aminoethenyl)-4-methylpiperidin-4-amine?
The canonical SMILES for 1-(1-aminoethenyl)-4-methylpiperidin-4-amine is C=C(N)N1CCC(C)(N)CC1.
What is the InChIKey of 1-(1-aminoethenyl)-4-methylpiperidin-4-amine?
The InChIKey is BZHDJZAEVZRKSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17N3/c1-7(9)11-5-3-8(2,10)4-6-11/h1,3-6,9-10H2,2H3.
What are the key properties of 1-(1-aminoethenyl)-4-methylpiperidin-4-amine?
1-(1-aminoethenyl)-4-methylpiperidin-4-amine has a molecular weight of 155.24 g/mol, XLogP of 0.23, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-aminoethenyl)-4-methylpiperidin-4-amine is sourced from PubChem (CID 166876536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).