N,7-dimethylfuro[3,2-d]pyrimidin-4-amine

C8H9N3O — CID 58308055

IUPACN,7-dimethylfuro[3,2-d]pyrimidin-4-amine
SMILESCNc1ncnc2c(C)coc12
InChIInChI=1S/C8H9N3O/c1-5-3-12-7-6(5)10-4-11-8(7)9-2/h3-4H,1-2H3,(H,9,10,11)
InChIKeyCCSJNODTDGUUQS-UHFFFAOYSA-N
MW163.18 g/mol
LogP1.57
Rot. Bonds1

About N,7-dimethylfuro[3,2-d]pyrimidin-4-amine

N,7-dimethylfuro[3,2-d]pyrimidin-4-amine (PubChem CID 58308055) has the molecular formula C8H9N3O and a molecular weight of 163.18 g/mol. Its IUPAC name is N,7-dimethylfuro[3,2-d]pyrimidin-4-amine.

Molecular Properties

Compound NameN,7-dimethylfuro[3,2-d]pyrimidin-4-amine
PubChem CID58308055
Molecular FormulaC8H9N3O
Molecular Weight163.18 g/mol
Exact Mass163.07
IUPAC NameN,7-dimethylfuro[3,2-d]pyrimidin-4-amine
SMILESCNc1ncnc2c(C)coc12
InChIInChI=1S/C8H9N3O/c1-5-3-12-7-6(5)10-4-11-8(7)9-2/h3-4H,1-2H3,(H,9,10,11)
InChIKeyCCSJNODTDGUUQS-UHFFFAOYSA-N
XLogP1.57
TPSA50.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.18
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N,7-dimethylfuro[3,2-d]pyrimidin-4-amine?
The IUPAC name of N,7-dimethylfuro[3,2-d]pyrimidin-4-amine (CID 58308055) is N,7-dimethylfuro[3,2-d]pyrimidin-4-amine.
What is the SMILES notation for N,7-dimethylfuro[3,2-d]pyrimidin-4-amine?
The canonical SMILES for N,7-dimethylfuro[3,2-d]pyrimidin-4-amine is CNc1ncnc2c(C)coc12.
What is the InChIKey of N,7-dimethylfuro[3,2-d]pyrimidin-4-amine?
The InChIKey is CCSJNODTDGUUQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N3O/c1-5-3-12-7-6(5)10-4-11-8(7)9-2/h3-4H,1-2H3,(H,9,10,11).
What are the key properties of N,7-dimethylfuro[3,2-d]pyrimidin-4-amine?
N,7-dimethylfuro[3,2-d]pyrimidin-4-amine has a molecular weight of 163.18 g/mol, XLogP of 1.57, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,7-dimethylfuro[3,2-d]pyrimidin-4-amine is sourced from PubChem (CID 58308055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).