6-imino-2,5-dihydropyridin-1-amine

C5H9N3 — CID 57319571

IUPAC6-imino-2,5-dihydropyridin-1-amine
SMILES[H]/N=C1\CC=CCN1N
InChIInChI=1S/C5H9N3/c6-5-3-1-2-4-8(5)7/h1-2,6H,3-4,7H2/b6-5+
InChIKeyFFHZTXXXXKUSOA-AATRIKPKSA-N
MW111.15 g/mol
LogP0.10
Rot. Bonds

About 6-imino-2,5-dihydropyridin-1-amine

6-imino-2,5-dihydropyridin-1-amine (PubChem CID 57319571) has the molecular formula C5H9N3 and a molecular weight of 111.15 g/mol. Its IUPAC name is 6-imino-2,5-dihydropyridin-1-amine.

Molecular Properties

Compound Name6-imino-2,5-dihydropyridin-1-amine
PubChem CID57319571
Molecular FormulaC5H9N3
Molecular Weight111.15 g/mol
Exact Mass111.08
IUPAC Name6-imino-2,5-dihydropyridin-1-amine
SMILES[H]/N=C1\CC=CCN1N
InChIInChI=1S/C5H9N3/c6-5-3-1-2-4-8(5)7/h1-2,6H,3-4,7H2/b6-5+
InChIKeyFFHZTXXXXKUSOA-AATRIKPKSA-N
XLogP0.10
TPSA53.11 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500111.15
LogP ≤ 50.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

6-Imino-2,3-dihydropyridin-1-amine
CID 53955967
1-Methyl-2,5-dihydropyridin-6-imine
CID 56616795
(1-Methyl-2,5-dihydropyridin-6-ylidene)hydrazine
CID 56628764
N-methyl-6-methylimino-2,5-dihydropyridin-1-amine
CID 57320112
6-Imino-5-methyl-2,3-dihydropyridin-1-amine
CID 90747431
6-Imino-2,5-dihydropyridine-1,5-diamine
CID 91290451
1-Chloro-2,5-dihydropyridin-6-imine
CID 91526954
1-(3,6-dihydro-2H-pyridin-1-yl)ethanimine
CID 152747753

Frequently Asked Questions

What is the IUPAC name of 6-imino-2,5-dihydropyridin-1-amine?
The IUPAC name of 6-imino-2,5-dihydropyridin-1-amine (CID 57319571) is 6-imino-2,5-dihydropyridin-1-amine.
What is the SMILES notation for 6-imino-2,5-dihydropyridin-1-amine?
The canonical SMILES for 6-imino-2,5-dihydropyridin-1-amine is [H]/N=C1\CC=CCN1N.
What is the InChIKey of 6-imino-2,5-dihydropyridin-1-amine?
The InChIKey is FFHZTXXXXKUSOA-AATRIKPKSA-N. The full InChI is InChI=1S/C5H9N3/c6-5-3-1-2-4-8(5)7/h1-2,6H,3-4,7H2/b6-5+.
What are the key properties of 6-imino-2,5-dihydropyridin-1-amine?
6-imino-2,5-dihydropyridin-1-amine has a molecular weight of 111.15 g/mol, XLogP of 0.10, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-imino-2,5-dihydropyridin-1-amine is sourced from PubChem (CID 57319571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).