6-N,6-N-bis(furan-2-ylmethyl)-7H-purine-2,6-diamine

C15H14N6O2 — CID 75505978

IUPAC6-N,6-N-bis(furan-2-ylmethyl)-7H-purine-2,6-diamine
SMILESNc1nc(N(Cc2ccco2)Cc2ccco2)c2[nH]cnc2n1
InChIInChI=1S/C15H14N6O2/c16-15-19-13-12(17-9-18-13)14(20-15)21(7-10-3-1-5-22-10)8-11-4-2-6-23-11/h1-6,9H,7-8H2,(H3,16,17,18,19,20)
InChIKeyFHUFIPFOIHZEMO-UHFFFAOYSA-N
MW310.32 g/mol
LogP2.33
Rot. Bonds5

About 6-N,6-N-bis(furan-2-ylmethyl)-7H-purine-2,6-diamine

6-N,6-N-bis(furan-2-ylmethyl)-7H-purine-2,6-diamine (PubChem CID 75505978) has the molecular formula C15H14N6O2 and a molecular weight of 310.32 g/mol. Its IUPAC name is 6-N,6-N-bis(furan-2-ylmethyl)-7H-purine-2,6-diamine.

Molecular Properties

Compound Name6-N,6-N-bis(furan-2-ylmethyl)-7H-purine-2,6-diamine
PubChem CID75505978
Molecular FormulaC15H14N6O2
Molecular Weight310.32 g/mol
Exact Mass310.12
IUPAC Name6-N,6-N-bis(furan-2-ylmethyl)-7H-purine-2,6-diamine
SMILESNc1nc(N(Cc2ccco2)Cc2ccco2)c2[nH]cnc2n1
InChIInChI=1S/C15H14N6O2/c16-15-19-13-12(17-9-18-13)14(20-15)21(7-10-3-1-5-22-10)8-11-4-2-6-23-11/h1-6,9H,7-8H2,(H3,16,17,18,19,20)
InChIKeyFHUFIPFOIHZEMO-UHFFFAOYSA-N
XLogP2.33
TPSA110.00 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.32
LogP ≤ 52.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

2-chloro-N-ethyl-N-(furan-2-ylmethyl)-7H-purin-6-amine
CID 104787205
6-N-(furan-2-ylmethyl)-2-N,6-N-dimethyl-7H-purine-2,6-diamine
CID 114783888
2-[(2-amino-7H-purin-6-yl)-benzylamino]ethanol
CID 114784943
6-N-ethyl-6-N-[(6-methyl-2-pyridinyl)methyl]-7H-purine-2,6-diamine
CID 114785682
6-N-[1-(furan-2-yl)ethyl]-7H-purine-2,6-diamine
CID 104623197
6-N-benzyl-6-N-propan-2-yl-7H-purine-2,6-diamine
CID 114783307
6-N-[(2-fluorophenyl)methyl]-6-N-methyl-7H-purine-2,6-diamine
CID 104623147
6-N-methyl-6-N-(2-phenylethyl)-7H-purine-2,6-diamine
CID 44776717
1-[(2-amino-7H-purin-6-yl)-ethylamino]-2-methylpropan-2-ol
CID 104623697
6-N-[(5-chlorothiophen-2-yl)methyl]-6-N-methyl-7H-purine-2,6-diamine
CID 115669357
N-(furan-2-ylmethyl)-N-methyl-2-[methyl(7H-purin-6-yl)amino]acetamide
CID 75466744
8-[6-[2-(furan-2-yl)ethyl]-7H-purin-2-yl]-7H-purin-6-amine
CID 123422552

Frequently Asked Questions

What is the IUPAC name of 6-N,6-N-bis(furan-2-ylmethyl)-7H-purine-2,6-diamine?
The IUPAC name of 6-N,6-N-bis(furan-2-ylmethyl)-7H-purine-2,6-diamine (CID 75505978) is 6-N,6-N-bis(furan-2-ylmethyl)-7H-purine-2,6-diamine.
What is the SMILES notation for 6-N,6-N-bis(furan-2-ylmethyl)-7H-purine-2,6-diamine?
The canonical SMILES for 6-N,6-N-bis(furan-2-ylmethyl)-7H-purine-2,6-diamine is Nc1nc(N(Cc2ccco2)Cc2ccco2)c2[nH]cnc2n1.
What is the InChIKey of 6-N,6-N-bis(furan-2-ylmethyl)-7H-purine-2,6-diamine?
The InChIKey is FHUFIPFOIHZEMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N6O2/c16-15-19-13-12(17-9-18-13)14(20-15)21(7-10-3-1-5-22-10)8-11-4-2-6-23-11/h1-6,9H,7-8H2,(H3,16,17,18,19,20).
What are the key properties of 6-N,6-N-bis(furan-2-ylmethyl)-7H-purine-2,6-diamine?
6-N,6-N-bis(furan-2-ylmethyl)-7H-purine-2,6-diamine has a molecular weight of 310.32 g/mol, XLogP of 2.33, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N,6-N-bis(furan-2-ylmethyl)-7H-purine-2,6-diamine is sourced from PubChem (CID 75505978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).