6,7-dimethyl-4-propan-2-yloxypteridin-2-amine

C11H15N5O — CID 822238

IUPAC6,7-dimethyl-4-propan-2-yloxypteridin-2-amine
SMILESCc1nc2nc(N)nc(OC(C)C)c2nc1C
InChIInChI=1S/C11H15N5O/c1-5(2)17-10-8-9(15-11(12)16-10)14-7(4)6(3)13-8/h5H,1-4H3,(H2,12,14,15,16)
InChIKeyBZCRKMQTHLHKRU-UHFFFAOYSA-N
MW233.27 g/mol
LogP1.41
Rot. Bonds2

About 6,7-dimethyl-4-propan-2-yloxypteridin-2-amine

6,7-dimethyl-4-propan-2-yloxypteridin-2-amine (PubChem CID 822238) has the molecular formula C11H15N5O and a molecular weight of 233.27 g/mol. Its IUPAC name is 6,7-dimethyl-4-propan-2-yloxypteridin-2-amine.

Molecular Properties

Compound Name6,7-dimethyl-4-propan-2-yloxypteridin-2-amine
PubChem CID822238
Molecular FormulaC11H15N5O
Molecular Weight233.27 g/mol
Exact Mass233.13
IUPAC Name6,7-dimethyl-4-propan-2-yloxypteridin-2-amine
SMILESCc1nc2nc(N)nc(OC(C)C)c2nc1C
InChIInChI=1S/C11H15N5O/c1-5(2)17-10-8-9(15-11(12)16-10)14-7(4)6(3)13-8/h5H,1-4H3,(H2,12,14,15,16)
InChIKeyBZCRKMQTHLHKRU-UHFFFAOYSA-N
XLogP1.41
TPSA86.81 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.27
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6,7-dimethyl-4-propan-2-yloxypteridin-2-amine?
The IUPAC name of 6,7-dimethyl-4-propan-2-yloxypteridin-2-amine (CID 822238) is 6,7-dimethyl-4-propan-2-yloxypteridin-2-amine.
What is the SMILES notation for 6,7-dimethyl-4-propan-2-yloxypteridin-2-amine?
The canonical SMILES for 6,7-dimethyl-4-propan-2-yloxypteridin-2-amine is Cc1nc2nc(N)nc(OC(C)C)c2nc1C.
What is the InChIKey of 6,7-dimethyl-4-propan-2-yloxypteridin-2-amine?
The InChIKey is BZCRKMQTHLHKRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5O/c1-5(2)17-10-8-9(15-11(12)16-10)14-7(4)6(3)13-8/h5H,1-4H3,(H2,12,14,15,16).
What are the key properties of 6,7-dimethyl-4-propan-2-yloxypteridin-2-amine?
6,7-dimethyl-4-propan-2-yloxypteridin-2-amine has a molecular weight of 233.27 g/mol, XLogP of 1.41, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7-dimethyl-4-propan-2-yloxypteridin-2-amine is sourced from PubChem (CID 822238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).