2,6-diimino-1,5-dimethylpiperidin-3-amine

C7H14N4 — CID 56638502

IUPAC2,6-diimino-1,5-dimethylpiperidin-3-amine
SMILES[H]/N=C1/C(N)CC(C)/C(=N\[H])N1C
InChIInChI=1S/C7H14N4/c1-4-3-5(8)7(10)11(2)6(4)9/h4-5,9-10H,3,8H2,1-2H3/b9-6+,10-7-
InChIKeyFRGROKALFJYKMW-FPXDHTHPSA-N
MW154.22 g/mol
LogP0.24
Rot. Bonds

About 2,6-diimino-1,5-dimethylpiperidin-3-amine

2,6-diimino-1,5-dimethylpiperidin-3-amine (PubChem CID 56638502) has the molecular formula C7H14N4 and a molecular weight of 154.22 g/mol. Its IUPAC name is 2,6-diimino-1,5-dimethylpiperidin-3-amine.

Molecular Properties

Compound Name2,6-diimino-1,5-dimethylpiperidin-3-amine
PubChem CID56638502
Molecular FormulaC7H14N4
Molecular Weight154.22 g/mol
Exact Mass154.12
IUPAC Name2,6-diimino-1,5-dimethylpiperidin-3-amine
SMILES[H]/N=C1/C(N)CC(C)/C(=N\[H])N1C
InChIInChI=1S/C7H14N4/c1-4-3-5(8)7(10)11(2)6(4)9/h4-5,9-10H,3,8H2,1-2H3/b9-6+,10-7-
InChIKeyFRGROKALFJYKMW-FPXDHTHPSA-N
XLogP0.24
TPSA76.96 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.22
LogP ≤ 50.24
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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 2,6-diimino-1,5-dimethylpiperidin-3-amine?
The IUPAC name of 2,6-diimino-1,5-dimethylpiperidin-3-amine (CID 56638502) is 2,6-diimino-1,5-dimethylpiperidin-3-amine.
What is the SMILES notation for 2,6-diimino-1,5-dimethylpiperidin-3-amine?
The canonical SMILES for 2,6-diimino-1,5-dimethylpiperidin-3-amine is [H]/N=C1/C(N)CC(C)/C(=N\[H])N1C.
What is the InChIKey of 2,6-diimino-1,5-dimethylpiperidin-3-amine?
The InChIKey is FRGROKALFJYKMW-FPXDHTHPSA-N. The full InChI is InChI=1S/C7H14N4/c1-4-3-5(8)7(10)11(2)6(4)9/h4-5,9-10H,3,8H2,1-2H3/b9-6+,10-7-.
What are the key properties of 2,6-diimino-1,5-dimethylpiperidin-3-amine?
2,6-diimino-1,5-dimethylpiperidin-3-amine has a molecular weight of 154.22 g/mol, XLogP of 0.24, 0 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-diimino-1,5-dimethylpiperidin-3-amine is sourced from PubChem (CID 56638502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).