4H-pyridin-1-amine

C5H8N2 — CID 18185605

IUPAC4H-pyridin-1-amine
SMILESNN1C=CCC=C1
InChIInChI=1S/C5H8N2/c6-7-4-2-1-3-5-7/h2-5H,1,6H2
InChIKeyJZMUXRUTQGTTTH-UHFFFAOYSA-N
MW96.13 g/mol
LogP0.59
Rot. Bonds

About 4H-pyridin-1-amine

4H-pyridin-1-amine (PubChem CID 18185605) has the molecular formula C5H8N2 and a molecular weight of 96.13 g/mol. Its IUPAC name is 4H-pyridin-1-amine.

Molecular Properties

Compound Name4H-pyridin-1-amine
PubChem CID18185605
Molecular FormulaC5H8N2
Molecular Weight96.13 g/mol
Exact Mass96.07
IUPAC Name4H-pyridin-1-amine
SMILESNN1C=CCC=C1
InChIInChI=1S/C5H8N2/c6-7-4-2-1-3-5-7/h2-5H,1,6H2
InChIKeyJZMUXRUTQGTTTH-UHFFFAOYSA-N
XLogP0.59
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50096.13
LogP ≤ 50.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4H-pyridin-1-amine?
The IUPAC name of 4H-pyridin-1-amine (CID 18185605) is 4H-pyridin-1-amine.
What is the SMILES notation for 4H-pyridin-1-amine?
The canonical SMILES for 4H-pyridin-1-amine is NN1C=CCC=C1.
What is the InChIKey of 4H-pyridin-1-amine?
The InChIKey is JZMUXRUTQGTTTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8N2/c6-7-4-2-1-3-5-7/h2-5H,1,6H2.
What are the key properties of 4H-pyridin-1-amine?
4H-pyridin-1-amine has a molecular weight of 96.13 g/mol, XLogP of 0.59, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4H-pyridin-1-amine is sourced from PubChem (CID 18185605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).