4-methoxy-6-(4-methylphenyl)pteridin-2-amine

C14H13N5O — CID 141068601

IUPAC4-methoxy-6-(4-methylphenyl)pteridin-2-amine
SMILESCOc1nc(N)nc2ncc(-c3ccc(C)cc3)nc12
InChIInChI=1S/C14H13N5O/c1-8-3-5-9(6-4-8)10-7-16-12-11(17-10)13(20-2)19-14(15)18-12/h3-7H,1-2H3,(H2,15,16,18,19)
InChIKeyCTDLQOCOVAXXQE-UHFFFAOYSA-N
MW267.29 g/mol
LogP1.99
Rot. Bonds2

About 4-methoxy-6-(4-methylphenyl)pteridin-2-amine

4-methoxy-6-(4-methylphenyl)pteridin-2-amine (PubChem CID 141068601) has the molecular formula C14H13N5O and a molecular weight of 267.29 g/mol. Its IUPAC name is 4-methoxy-6-(4-methylphenyl)pteridin-2-amine.

Molecular Properties

Compound Name4-methoxy-6-(4-methylphenyl)pteridin-2-amine
PubChem CID141068601
Molecular FormulaC14H13N5O
Molecular Weight267.29 g/mol
Exact Mass267.11
IUPAC Name4-methoxy-6-(4-methylphenyl)pteridin-2-amine
SMILESCOc1nc(N)nc2ncc(-c3ccc(C)cc3)nc12
InChIInChI=1S/C14H13N5O/c1-8-3-5-9(6-4-8)10-7-16-12-11(17-10)13(20-2)19-14(15)18-12/h3-7H,1-2H3,(H2,15,16,18,19)
InChIKeyCTDLQOCOVAXXQE-UHFFFAOYSA-N
XLogP1.99
TPSA86.81 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.29
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-6-(4-methylphenyl)pteridin-2-amine?
The IUPAC name of 4-methoxy-6-(4-methylphenyl)pteridin-2-amine (CID 141068601) is 4-methoxy-6-(4-methylphenyl)pteridin-2-amine.
What is the SMILES notation for 4-methoxy-6-(4-methylphenyl)pteridin-2-amine?
The canonical SMILES for 4-methoxy-6-(4-methylphenyl)pteridin-2-amine is COc1nc(N)nc2ncc(-c3ccc(C)cc3)nc12.
What is the InChIKey of 4-methoxy-6-(4-methylphenyl)pteridin-2-amine?
The InChIKey is CTDLQOCOVAXXQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N5O/c1-8-3-5-9(6-4-8)10-7-16-12-11(17-10)13(20-2)19-14(15)18-12/h3-7H,1-2H3,(H2,15,16,18,19).
What are the key properties of 4-methoxy-6-(4-methylphenyl)pteridin-2-amine?
4-methoxy-6-(4-methylphenyl)pteridin-2-amine has a molecular weight of 267.29 g/mol, XLogP of 1.99, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-6-(4-methylphenyl)pteridin-2-amine is sourced from PubChem (CID 141068601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).