4-(5,6,7,8-tetrahydronaphthalen-2-yloxy)pyrimidin-5-amine

C14H15N3O — CID 79916312

IUPAC4-(5,6,7,8-tetrahydronaphthalen-2-yloxy)pyrimidin-5-amine
SMILESNc1cncnc1Oc1ccc2c(c1)CCCC2
InChIInChI=1S/C14H15N3O/c15-13-8-16-9-17-14(13)18-12-6-5-10-3-1-2-4-11(10)7-12/h5-9H,1-4,15H2
InChIKeyARXXSZKHULQLII-UHFFFAOYSA-N
MW241.29 g/mol
LogP2.73
Rot. Bonds2

About 4-(5,6,7,8-tetrahydronaphthalen-2-yloxy)pyrimidin-5-amine

4-(5,6,7,8-tetrahydronaphthalen-2-yloxy)pyrimidin-5-amine (PubChem CID 79916312) has the molecular formula C14H15N3O and a molecular weight of 241.29 g/mol. Its IUPAC name is 4-(5,6,7,8-tetrahydronaphthalen-2-yloxy)pyrimidin-5-amine.

Molecular Properties

Compound Name4-(5,6,7,8-tetrahydronaphthalen-2-yloxy)pyrimidin-5-amine
PubChem CID79916312
Molecular FormulaC14H15N3O
Molecular Weight241.29 g/mol
Exact Mass241.12
IUPAC Name4-(5,6,7,8-tetrahydronaphthalen-2-yloxy)pyrimidin-5-amine
SMILESNc1cncnc1Oc1ccc2c(c1)CCCC2
InChIInChI=1S/C14H15N3O/c15-13-8-16-9-17-14(13)18-12-6-5-10-3-1-2-4-11(10)7-12/h5-9H,1-4,15H2
InChIKeyARXXSZKHULQLII-UHFFFAOYSA-N
XLogP2.73
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(5,6,7,8-tetrahydronaphthalen-2-yloxy)pyrimidin-5-amine?
The IUPAC name of 4-(5,6,7,8-tetrahydronaphthalen-2-yloxy)pyrimidin-5-amine (CID 79916312) is 4-(5,6,7,8-tetrahydronaphthalen-2-yloxy)pyrimidin-5-amine.
What is the SMILES notation for 4-(5,6,7,8-tetrahydronaphthalen-2-yloxy)pyrimidin-5-amine?
The canonical SMILES for 4-(5,6,7,8-tetrahydronaphthalen-2-yloxy)pyrimidin-5-amine is Nc1cncnc1Oc1ccc2c(c1)CCCC2.
What is the InChIKey of 4-(5,6,7,8-tetrahydronaphthalen-2-yloxy)pyrimidin-5-amine?
The InChIKey is ARXXSZKHULQLII-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O/c15-13-8-16-9-17-14(13)18-12-6-5-10-3-1-2-4-11(10)7-12/h5-9H,1-4,15H2.
What are the key properties of 4-(5,6,7,8-tetrahydronaphthalen-2-yloxy)pyrimidin-5-amine?
4-(5,6,7,8-tetrahydronaphthalen-2-yloxy)pyrimidin-5-amine has a molecular weight of 241.29 g/mol, XLogP of 2.73, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5,6,7,8-tetrahydronaphthalen-2-yloxy)pyrimidin-5-amine is sourced from PubChem (CID 79916312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).