2H-pyridine-2,4,5,5-tetramine

C5H11N5 — CID 67893116

IUPAC2H-pyridine-2,4,5,5-tetramine
SMILESNC1=CC(N)N=CC1(N)N
InChIInChI=1S/C5H11N5/c6-3-1-4(7)10-2-5(3,8)9/h1-2,4H,6-9H2
InChIKeyWOOZEFJODFFIAT-UHFFFAOYSA-N
MW141.18 g/mol
LogP-2.19
Rot. Bonds

About 2H-pyridine-2,4,5,5-tetramine

2H-pyridine-2,4,5,5-tetramine (PubChem CID 67893116) has the molecular formula C5H11N5 and a molecular weight of 141.18 g/mol. Its IUPAC name is 2H-pyridine-2,4,5,5-tetramine.

Molecular Properties

Compound Name2H-pyridine-2,4,5,5-tetramine
PubChem CID67893116
Molecular FormulaC5H11N5
Molecular Weight141.18 g/mol
Exact Mass141.10
IUPAC Name2H-pyridine-2,4,5,5-tetramine
SMILESNC1=CC(N)N=CC1(N)N
InChIInChI=1S/C5H11N5/c6-3-1-4(7)10-2-5(3,8)9/h1-2,4H,6-9H2
InChIKeyWOOZEFJODFFIAT-UHFFFAOYSA-N
XLogP-2.19
TPSA116.44 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.18
LogP ≤ 5-2.19
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2H-pyridine-2,4,5,5-tetramine?
The IUPAC name of 2H-pyridine-2,4,5,5-tetramine (CID 67893116) is 2H-pyridine-2,4,5,5-tetramine.
What is the SMILES notation for 2H-pyridine-2,4,5,5-tetramine?
The canonical SMILES for 2H-pyridine-2,4,5,5-tetramine is NC1=CC(N)N=CC1(N)N.
What is the InChIKey of 2H-pyridine-2,4,5,5-tetramine?
The InChIKey is WOOZEFJODFFIAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11N5/c6-3-1-4(7)10-2-5(3,8)9/h1-2,4H,6-9H2.
What are the key properties of 2H-pyridine-2,4,5,5-tetramine?
2H-pyridine-2,4,5,5-tetramine has a molecular weight of 141.18 g/mol, XLogP of -2.19, 0 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2H-pyridine-2,4,5,5-tetramine is sourced from PubChem (CID 67893116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).