6,7-dimethyl-4-phenylmethoxypteridin-2-amine

C15H15N5O — CID 822237

IUPAC6,7-dimethyl-4-phenylmethoxypteridin-2-amine
SMILESCc1nc2nc(N)nc(OCc3ccccc3)c2nc1C
InChIInChI=1S/C15H15N5O/c1-9-10(2)18-13-12(17-9)14(20-15(16)19-13)21-8-11-6-4-3-5-7-11/h3-7H,8H2,1-2H3,(H2,16,18,19,20)
InChIKeyWQJQFFJAILLJTD-UHFFFAOYSA-N
MW281.32 g/mol
LogP2.20
Rot. Bonds3

About 6,7-dimethyl-4-phenylmethoxypteridin-2-amine

6,7-dimethyl-4-phenylmethoxypteridin-2-amine (PubChem CID 822237) has the molecular formula C15H15N5O and a molecular weight of 281.32 g/mol. Its IUPAC name is 6,7-dimethyl-4-phenylmethoxypteridin-2-amine.

Molecular Properties

Compound Name6,7-dimethyl-4-phenylmethoxypteridin-2-amine
PubChem CID822237
Molecular FormulaC15H15N5O
Molecular Weight281.32 g/mol
Exact Mass281.13
IUPAC Name6,7-dimethyl-4-phenylmethoxypteridin-2-amine
SMILESCc1nc2nc(N)nc(OCc3ccccc3)c2nc1C
InChIInChI=1S/C15H15N5O/c1-9-10(2)18-13-12(17-9)14(20-15(16)19-13)21-8-11-6-4-3-5-7-11/h3-7H,8H2,1-2H3,(H2,16,18,19,20)
InChIKeyWQJQFFJAILLJTD-UHFFFAOYSA-N
XLogP2.20
TPSA86.81 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.32
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

6-(Phenylmethoxy)-9H-purin-2-amine
CID 4578
6-Benzyloxypurine
CID 853677
7-phenylmethoxy-2H-triazolo[4,5-d]pyrimidin-5-amine
CID 6418797
Pteridine, 2-amino-4-benzoxy-
CID 10332482
1H-Purin-2-amine, 8-bromo-6-(phenylmethoxy)-
CID 9797127
2,5,6-Triamino-4-Benzyloxypyrimidine
CID 9816044
1H-Purin-2-amine, 6-(phenylmethoxy)-8-(trifluoromethyl)-
CID 9972589
1H-Purin-2-amine, 8-methyl-6-(phenylmethoxy)-
CID 10015222
9-Methyl-6-phenylmethoxypurin-2-amine
CID 10083691
6-phenylmethoxy-7H-purine-2,8-diamine
CID 10244118
9H-Purine-9-acetonitrile, 2-amino-6-(phenylmethoxy)-
CID 10468863
(2-Amino-4-phenylmethoxypteridin-6-yl)methanol
CID 11150259

Frequently Asked Questions

What is the IUPAC name of 6,7-dimethyl-4-phenylmethoxypteridin-2-amine?
The IUPAC name of 6,7-dimethyl-4-phenylmethoxypteridin-2-amine (CID 822237) is 6,7-dimethyl-4-phenylmethoxypteridin-2-amine.
What is the SMILES notation for 6,7-dimethyl-4-phenylmethoxypteridin-2-amine?
The canonical SMILES for 6,7-dimethyl-4-phenylmethoxypteridin-2-amine is Cc1nc2nc(N)nc(OCc3ccccc3)c2nc1C.
What is the InChIKey of 6,7-dimethyl-4-phenylmethoxypteridin-2-amine?
The InChIKey is WQJQFFJAILLJTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N5O/c1-9-10(2)18-13-12(17-9)14(20-15(16)19-13)21-8-11-6-4-3-5-7-11/h3-7H,8H2,1-2H3,(H2,16,18,19,20).
What are the key properties of 6,7-dimethyl-4-phenylmethoxypteridin-2-amine?
6,7-dimethyl-4-phenylmethoxypteridin-2-amine has a molecular weight of 281.32 g/mol, XLogP of 2.20, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7-dimethyl-4-phenylmethoxypteridin-2-amine is sourced from PubChem (CID 822237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).