1-(5,7-dihydrofuro[3,4-d]pyrimidin-2-yl)piperidin-3-amine

C11H16N4O — CID 83837795

IUPAC1-(5,7-dihydrofuro[3,4-d]pyrimidin-2-yl)piperidin-3-amine
SMILESNC1CCCN(c2ncc3c(n2)COC3)C1
InChIInChI=1S/C11H16N4O/c12-9-2-1-3-15(5-9)11-13-4-8-6-16-7-10(8)14-11/h4,9H,1-3,5-7,12H2
InChIKeyHWGWQPRXBHOIBK-UHFFFAOYSA-N
MW220.28 g/mol
LogP0.43
Rot. Bonds1

About 1-(5,7-dihydrofuro[3,4-d]pyrimidin-2-yl)piperidin-3-amine

1-(5,7-dihydrofuro[3,4-d]pyrimidin-2-yl)piperidin-3-amine (PubChem CID 83837795) has the molecular formula C11H16N4O and a molecular weight of 220.28 g/mol. Its IUPAC name is 1-(5,7-dihydrofuro[3,4-d]pyrimidin-2-yl)piperidin-3-amine.

Molecular Properties

Compound Name1-(5,7-dihydrofuro[3,4-d]pyrimidin-2-yl)piperidin-3-amine
PubChem CID83837795
Molecular FormulaC11H16N4O
Molecular Weight220.28 g/mol
Exact Mass220.13
IUPAC Name1-(5,7-dihydrofuro[3,4-d]pyrimidin-2-yl)piperidin-3-amine
SMILESNC1CCCN(c2ncc3c(n2)COC3)C1
InChIInChI=1S/C11H16N4O/c12-9-2-1-3-15(5-9)11-13-4-8-6-16-7-10(8)14-11/h4,9H,1-3,5-7,12H2
InChIKeyHWGWQPRXBHOIBK-UHFFFAOYSA-N
XLogP0.43
TPSA64.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.28
LogP ≤ 50.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-(5,7-dihydrofuro[3,4-d]pyrimidin-2-yl)piperidin-3-amine?
The IUPAC name of 1-(5,7-dihydrofuro[3,4-d]pyrimidin-2-yl)piperidin-3-amine (CID 83837795) is 1-(5,7-dihydrofuro[3,4-d]pyrimidin-2-yl)piperidin-3-amine.
What is the SMILES notation for 1-(5,7-dihydrofuro[3,4-d]pyrimidin-2-yl)piperidin-3-amine?
The canonical SMILES for 1-(5,7-dihydrofuro[3,4-d]pyrimidin-2-yl)piperidin-3-amine is NC1CCCN(c2ncc3c(n2)COC3)C1.
What is the InChIKey of 1-(5,7-dihydrofuro[3,4-d]pyrimidin-2-yl)piperidin-3-amine?
The InChIKey is HWGWQPRXBHOIBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O/c12-9-2-1-3-15(5-9)11-13-4-8-6-16-7-10(8)14-11/h4,9H,1-3,5-7,12H2.
What are the key properties of 1-(5,7-dihydrofuro[3,4-d]pyrimidin-2-yl)piperidin-3-amine?
1-(5,7-dihydrofuro[3,4-d]pyrimidin-2-yl)piperidin-3-amine has a molecular weight of 220.28 g/mol, XLogP of 0.43, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5,7-dihydrofuro[3,4-d]pyrimidin-2-yl)piperidin-3-amine is sourced from PubChem (CID 83837795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).