2,3-dihydropyridin-4-amine

C5H8N2 — CID 19906283

IUPAC2,3-dihydropyridin-4-amine
SMILESNC1=CC=NCC1
InChIInChI=1S/C5H8N2/c6-5-1-3-7-4-2-5/h1,3H,2,4,6H2
InChIKeyHBKSJDGGEGGNGJ-UHFFFAOYSA-N
MW96.13 g/mol
LogP0.30
Rot. Bonds

About 2,3-dihydropyridin-4-amine

2,3-dihydropyridin-4-amine (PubChem CID 19906283) has the molecular formula C5H8N2 and a molecular weight of 96.13 g/mol. Its IUPAC name is 2,3-dihydropyridin-4-amine.

Molecular Properties

Compound Name2,3-dihydropyridin-4-amine
PubChem CID19906283
Molecular FormulaC5H8N2
Molecular Weight96.13 g/mol
Exact Mass96.07
IUPAC Name2,3-dihydropyridin-4-amine
SMILESNC1=CC=NCC1
InChIInChI=1S/C5H8N2/c6-5-1-3-7-4-2-5/h1,3H,2,4,6H2
InChIKeyHBKSJDGGEGGNGJ-UHFFFAOYSA-N
XLogP0.30
TPSA38.38 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 ≤ 50.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,3-dihydropyridin-4-amine?
The IUPAC name of 2,3-dihydropyridin-4-amine (CID 19906283) is 2,3-dihydropyridin-4-amine.
What is the SMILES notation for 2,3-dihydropyridin-4-amine?
The canonical SMILES for 2,3-dihydropyridin-4-amine is NC1=CC=NCC1.
What is the InChIKey of 2,3-dihydropyridin-4-amine?
The InChIKey is HBKSJDGGEGGNGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8N2/c6-5-1-3-7-4-2-5/h1,3H,2,4,6H2.
What are the key properties of 2,3-dihydropyridin-4-amine?
2,3-dihydropyridin-4-amine has a molecular weight of 96.13 g/mol, XLogP of 0.30, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydropyridin-4-amine is sourced from PubChem (CID 19906283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).