9-(cyclobutylidenemethyl)purin-6-amine

C10H11N5 — CID 91149333

IUPAC9-(cyclobutylidenemethyl)purin-6-amine
SMILESNc1ncnc2c1ncn2C=C1CCC1
InChIInChI=1S/C10H11N5/c11-9-8-10(13-5-12-9)15(6-14-8)4-7-2-1-3-7/h4-6H,1-3H2,(H2,11,12,13)
InChIKeyHOKWPLQAWVXFGB-UHFFFAOYSA-N
MW201.23 g/mol
LogP1.43
Rot. Bonds1

About 9-(cyclobutylidenemethyl)purin-6-amine

9-(cyclobutylidenemethyl)purin-6-amine (PubChem CID 91149333) has the molecular formula C10H11N5 and a molecular weight of 201.23 g/mol. Its IUPAC name is 9-(cyclobutylidenemethyl)purin-6-amine.

Molecular Properties

Compound Name9-(cyclobutylidenemethyl)purin-6-amine
PubChem CID91149333
Molecular FormulaC10H11N5
Molecular Weight201.23 g/mol
Exact Mass201.10
IUPAC Name9-(cyclobutylidenemethyl)purin-6-amine
SMILESNc1ncnc2c1ncn2C=C1CCC1
InChIInChI=1S/C10H11N5/c11-9-8-10(13-5-12-9)15(6-14-8)4-7-2-1-3-7/h4-6H,1-3H2,(H2,11,12,13)
InChIKeyHOKWPLQAWVXFGB-UHFFFAOYSA-N
XLogP1.43
TPSA69.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.23
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[(1S,3R)-2-[(6-aminopurin-9-yl)methylidene]-3-(hydroxymethyl)cyclopropyl]methanol
CID 11064729
[(1S,2Z)-2-[(6-aminopurin-9-yl)methylidene]cyclopropyl]methanol
CID 3001845
[(1R,2E)-2-[(6-aminopurin-9-yl)methylidene]cyclopropyl]methyl acetate
CID 10825162
(6-aminopurin-9-yl) formate
CID 57250144
1-(6-aminopurin-9-yl)cyclopentan-1-ol
CID 140969390
9-[4,6-bis(6-aminopurin-9-yl)-1,3,5-triazin-2-yl]purin-6-amine
CID 102192385
9-phosphorosopurin-6-amine
CID 57110561
[[(2Z)-2-[(6-aminopurin-9-yl)methylidene]cyclopropyl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate
CID 3011615
9-(2-cyclopentylethyl)purin-6-amine
CID 123505932
[(1S,2S,3S)-3-(6-aminopurin-9-yl)-2-(hydroxymethyl)cyclobutyl]methanol
CID 10562568
[2-[2-(6-aminopurin-9-yl)ethylidene]cyclobutyl]methanol
CID 71427271
5-(6-aminopurin-9-yl)-2-(hydroxymethyl)thiolan-3-ol
CID 23358719

Frequently Asked Questions

What is the IUPAC name of 9-(cyclobutylidenemethyl)purin-6-amine?
The IUPAC name of 9-(cyclobutylidenemethyl)purin-6-amine (CID 91149333) is 9-(cyclobutylidenemethyl)purin-6-amine.
What is the SMILES notation for 9-(cyclobutylidenemethyl)purin-6-amine?
The canonical SMILES for 9-(cyclobutylidenemethyl)purin-6-amine is Nc1ncnc2c1ncn2C=C1CCC1.
What is the InChIKey of 9-(cyclobutylidenemethyl)purin-6-amine?
The InChIKey is HOKWPLQAWVXFGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N5/c11-9-8-10(13-5-12-9)15(6-14-8)4-7-2-1-3-7/h4-6H,1-3H2,(H2,11,12,13).
What are the key properties of 9-(cyclobutylidenemethyl)purin-6-amine?
9-(cyclobutylidenemethyl)purin-6-amine has a molecular weight of 201.23 g/mol, XLogP of 1.43, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(cyclobutylidenemethyl)purin-6-amine is sourced from PubChem (CID 91149333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).