2-(furan-2-yl)-7H-purine

C9H6N4O — CID 69436374

IUPAC2-(furan-2-yl)-7H-purine
SMILESc1coc(-c2ncc3[nH]cnc3n2)c1
InChIInChI=1S/C9H6N4O/c1-2-7(14-3-1)9-10-4-6-8(13-9)12-5-11-6/h1-5H,(H,10,11,12,13)
InChIKeyBNRMNJDPIILASR-UHFFFAOYSA-N
MW186.17 g/mol
LogP1.61
Rot. Bonds1

About 2-(furan-2-yl)-7H-purine

2-(furan-2-yl)-7H-purine (PubChem CID 69436374) has the molecular formula C9H6N4O and a molecular weight of 186.17 g/mol. Its IUPAC name is 2-(furan-2-yl)-7H-purine.

Molecular Properties

Compound Name2-(furan-2-yl)-7H-purine
PubChem CID69436374
Molecular FormulaC9H6N4O
Molecular Weight186.17 g/mol
Exact Mass186.05
IUPAC Name2-(furan-2-yl)-7H-purine
SMILESc1coc(-c2ncc3[nH]cnc3n2)c1
InChIInChI=1S/C9H6N4O/c1-2-7(14-3-1)9-10-4-6-8(13-9)12-5-11-6/h1-5H,(H,10,11,12,13)
InChIKeyBNRMNJDPIILASR-UHFFFAOYSA-N
XLogP1.61
TPSA67.60 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.17
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(furan-2-yl)-5-(5-phenyl-1H-imidazol-4-yl)pyrimidine
CID 50963722
2-(furan-2-yl)pyrido[3,2-d]pyrimidine
CID 101478815
2-[4-(3H-benzimidazol-5-yl)phenyl]-7H-purine
CID 89475023
1-[2-(furan-2-yl)-4-methylpyrimidin-5-yl]ethanamine
CID 62771891
(1R)-1-[2-(furan-2-yl)-4-methylpyrimidin-5-yl]ethanamine
CID 94587547
O-[6-(furan-2-yl)-7H-purin-2-yl] methanethioate
CID 87502540
4-ethyl-2-(furan-2-yl)pyrimidin-5-amine
CID 82374827
(1S)-1-[2-(furan-2-yl)-4-methylpyrimidin-5-yl]ethanol
CID 103431623
[2-(furan-2-yl)pyrimidin-5-yl]hydrazine
CID 134693283
2-(furan-2-yl)-1,3,5-triazine
CID 54453407
[2-(furan-2-yl)pyrimidin-4-yl]-trimethylstannane
CID 168921538
2-(furan-2-yl)-6-methyl-1H-imidazo[4,5-b]pyridine
CID 79795542

Frequently Asked Questions

What is the IUPAC name of 2-(furan-2-yl)-7H-purine?
The IUPAC name of 2-(furan-2-yl)-7H-purine (CID 69436374) is 2-(furan-2-yl)-7H-purine.
What is the SMILES notation for 2-(furan-2-yl)-7H-purine?
The canonical SMILES for 2-(furan-2-yl)-7H-purine is c1coc(-c2ncc3[nH]cnc3n2)c1.
What is the InChIKey of 2-(furan-2-yl)-7H-purine?
The InChIKey is BNRMNJDPIILASR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H6N4O/c1-2-7(14-3-1)9-10-4-6-8(13-9)12-5-11-6/h1-5H,(H,10,11,12,13).
What are the key properties of 2-(furan-2-yl)-7H-purine?
2-(furan-2-yl)-7H-purine has a molecular weight of 186.17 g/mol, XLogP of 1.61, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-2-yl)-7H-purine is sourced from PubChem (CID 69436374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).