6-(3,6-dihydro-2H-pyridin-1-yl)-7H-purin-2-amine

C10H12N6 — CID 104623927

IUPAC6-(3,6-dihydro-2H-pyridin-1-yl)-7H-purin-2-amine
SMILESNc1nc(N2CC=CCC2)c2[nH]cnc2n1
InChIInChI=1S/C10H12N6/c11-10-14-8-7(12-6-13-8)9(15-10)16-4-2-1-3-5-16/h1-2,6H,3-5H2,(H3,11,12,13,14,15)
InChIKeyFXFIYVVJAQFJDK-UHFFFAOYSA-N
MW216.25 g/mol
LogP0.70
Rot. Bonds1

About 6-(3,6-dihydro-2H-pyridin-1-yl)-7H-purin-2-amine

6-(3,6-dihydro-2H-pyridin-1-yl)-7H-purin-2-amine (PubChem CID 104623927) has the molecular formula C10H12N6 and a molecular weight of 216.25 g/mol. Its IUPAC name is 6-(3,6-dihydro-2H-pyridin-1-yl)-7H-purin-2-amine.

Molecular Properties

Compound Name6-(3,6-dihydro-2H-pyridin-1-yl)-7H-purin-2-amine
PubChem CID104623927
Molecular FormulaC10H12N6
Molecular Weight216.25 g/mol
Exact Mass216.11
IUPAC Name6-(3,6-dihydro-2H-pyridin-1-yl)-7H-purin-2-amine
SMILESNc1nc(N2CC=CCC2)c2[nH]cnc2n1
InChIInChI=1S/C10H12N6/c11-10-14-8-7(12-6-13-8)9(15-10)16-4-2-1-3-5-16/h1-2,6H,3-5H2,(H3,11,12,13,14,15)
InChIKeyFXFIYVVJAQFJDK-UHFFFAOYSA-N
XLogP0.70
TPSA83.72 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.25
LogP ≤ 50.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 6-(3,6-dihydro-2H-pyridin-1-yl)-7H-purin-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-(4-methylpiperidin-1-yl)-7H-purin-2-amine
CID 44776716
4-(2-amino-7H-purin-6-yl)piperazine-2,6-dione
CID 114785546
6-(8-azaspiro[4.5]decan-8-yl)-7H-purin-2-amine
CID 104623737
6-(4-propan-2-ylpiperazin-1-yl)-7H-purin-2-amine
CID 115669377
1-(2-amino-7H-purin-6-yl)-3-methylpiperidin-4-ol
CID 114749498
6-(3-methoxypyrrolidin-1-yl)-7H-purin-2-amine
CID 103541736
1-(2-amino-7H-purin-6-yl)-3-methylpyrrolidin-3-ol
CID 104623816
1-(2-amino-7H-purin-6-yl)piperidine-3-carboxamide
CID 115669348
[4-(2-amino-7H-purin-6-yl)piperazin-1-yl]-phenylmethanone
CID 39046359
6-(6-fluoro-2-azaspiro[3.3]heptan-2-yl)-7H-purin-2-amine
CID 177211825
6-[3-(2-methylpiperidin-1-yl)azetidin-1-yl]-7H-purin-2-amine
CID 72902832
1-[4-(2-amino-7H-purin-6-yl)piperazin-1-yl]-2-methylpropan-1-one
CID 166212074

Frequently Asked Questions

What is the IUPAC name of 6-(3,6-dihydro-2H-pyridin-1-yl)-7H-purin-2-amine?
The IUPAC name of 6-(3,6-dihydro-2H-pyridin-1-yl)-7H-purin-2-amine (CID 104623927) is 6-(3,6-dihydro-2H-pyridin-1-yl)-7H-purin-2-amine.
What is the SMILES notation for 6-(3,6-dihydro-2H-pyridin-1-yl)-7H-purin-2-amine?
The canonical SMILES for 6-(3,6-dihydro-2H-pyridin-1-yl)-7H-purin-2-amine is Nc1nc(N2CC=CCC2)c2[nH]cnc2n1.
What is the InChIKey of 6-(3,6-dihydro-2H-pyridin-1-yl)-7H-purin-2-amine?
The InChIKey is FXFIYVVJAQFJDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N6/c11-10-14-8-7(12-6-13-8)9(15-10)16-4-2-1-3-5-16/h1-2,6H,3-5H2,(H3,11,12,13,14,15).
What are the key properties of 6-(3,6-dihydro-2H-pyridin-1-yl)-7H-purin-2-amine?
6-(3,6-dihydro-2H-pyridin-1-yl)-7H-purin-2-amine has a molecular weight of 216.25 g/mol, XLogP of 0.70, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3,6-dihydro-2H-pyridin-1-yl)-7H-purin-2-amine is sourced from PubChem (CID 104623927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).