6-phenylpteridin-4-amine

C12H9N5 — CID 10513277

IUPAC6-phenylpteridin-4-amine
SMILESNc1ncnc2ncc(-c3ccccc3)nc12
InChIInChI=1S/C12H9N5/c13-11-10-12(16-7-15-11)14-6-9(17-10)8-4-2-1-3-5-8/h1-7H,(H2,13,14,15,16)
InChIKeyFXKPEYTWAKGVLS-UHFFFAOYSA-N
MW223.24 g/mol
LogP1.67
Rot. Bonds1

About 6-phenylpteridin-4-amine

6-phenylpteridin-4-amine (PubChem CID 10513277) has the molecular formula C12H9N5 and a molecular weight of 223.24 g/mol. Its IUPAC name is 6-phenylpteridin-4-amine.

Molecular Properties

Compound Name6-phenylpteridin-4-amine
PubChem CID10513277
Molecular FormulaC12H9N5
Molecular Weight223.24 g/mol
Exact Mass223.09
IUPAC Name6-phenylpteridin-4-amine
SMILESNc1ncnc2ncc(-c3ccccc3)nc12
InChIInChI=1S/C12H9N5/c13-11-10-12(16-7-15-11)14-6-9(17-10)8-4-2-1-3-5-8/h1-7H,(H2,13,14,15,16)
InChIKeyFXKPEYTWAKGVLS-UHFFFAOYSA-N
XLogP1.67
TPSA77.58 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.24
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2,6-diphenylpteridin-4-amine
CID 15313166
4-amino-6-phenylpteridine-7-carboxamide
CID 71406760
6-phenyl-8-N-propan-2-ylpyrido[3,2-d]pyrimidine-4,8-diamine
CID 163213205
6-pyridin-2-yl-7-pyridin-3-ylpteridin-4-amine;sulfuric acid
CID 68768556
5-phenyl-[1,2,5]oxadiazolo[3,4-b]pyrazine
CID 588207
2-methyl-6-(3-methylphenyl)pteridin-4-amine
CID 155363915
5-(3-bromophenyl)-7-phenylpyrido[2,3-d]pyrimidin-4-amine
CID 54384444
1-(3-amino-6-phenylpyrazin-2-yl)ethanone
CID 58840776
3-phenyl-6,7-dihydropyrazino[2,3-d]pyridazine-5,8-dione
CID 131845977
5-phenyl-3H-imidazo[4,5-b]pyrazine
CID 142671965
3-[4-amino-7-(3-hydroxyphenyl)pteridin-6-yl]phenol;hydrobromide
CID 69016478
4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-11-phenyl-3,6,9,12,15,18-hexazatetracyclo[12.4.0.02,7.08,13]octadeca-1(18),2,4,6,8,10,12,14,16-nonaene
CID 155765285

Frequently Asked Questions

What is the IUPAC name of 6-phenylpteridin-4-amine?
The IUPAC name of 6-phenylpteridin-4-amine (CID 10513277) is 6-phenylpteridin-4-amine.
What is the SMILES notation for 6-phenylpteridin-4-amine?
The canonical SMILES for 6-phenylpteridin-4-amine is Nc1ncnc2ncc(-c3ccccc3)nc12.
What is the InChIKey of 6-phenylpteridin-4-amine?
The InChIKey is FXKPEYTWAKGVLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9N5/c13-11-10-12(16-7-15-11)14-6-9(17-10)8-4-2-1-3-5-8/h1-7H,(H2,13,14,15,16).
What are the key properties of 6-phenylpteridin-4-amine?
6-phenylpteridin-4-amine has a molecular weight of 223.24 g/mol, XLogP of 1.67, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-phenylpteridin-4-amine is sourced from PubChem (CID 10513277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).