2,6-diphenylpteridin-4-amine

C18H13N5 — CID 15313166

IUPAC2,6-diphenylpteridin-4-amine
SMILESNc1nc(-c2ccccc2)nc2ncc(-c3ccccc3)nc12
InChIInChI=1S/C18H13N5/c19-16-15-18(23-17(22-16)13-9-5-2-6-10-13)20-11-14(21-15)12-7-3-1-4-8-12/h1-11H,(H2,19,20,22,23)
InChIKeyPBDIBKDFKRLTMZ-UHFFFAOYSA-N
MW299.34 g/mol
LogP3.34
Rot. Bonds2

About 2,6-diphenylpteridin-4-amine

2,6-diphenylpteridin-4-amine (PubChem CID 15313166) has the molecular formula C18H13N5 and a molecular weight of 299.34 g/mol. Its IUPAC name is 2,6-diphenylpteridin-4-amine.

Molecular Properties

Compound Name2,6-diphenylpteridin-4-amine
PubChem CID15313166
Molecular FormulaC18H13N5
Molecular Weight299.34 g/mol
Exact Mass299.12
IUPAC Name2,6-diphenylpteridin-4-amine
SMILESNc1nc(-c2ccccc2)nc2ncc(-c3ccccc3)nc12
InChIInChI=1S/C18H13N5/c19-16-15-18(23-17(22-16)13-9-5-2-6-10-13)20-11-14(21-15)12-7-3-1-4-8-12/h1-11H,(H2,19,20,22,23)
InChIKeyPBDIBKDFKRLTMZ-UHFFFAOYSA-N
XLogP3.34
TPSA77.58 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.34
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-phenylpteridin-4-amine
CID 10513277
5-phenyl-2H-triazolo[4,5-d]pyrimidin-7-amine
CID 67266146
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
2-methyl-6-(3-methylphenyl)pteridin-4-amine
CID 155363915
2,5-diphenyl-[1,3]thiazolo[5,4-d]pyrimidin-7-amine
CID 155543719
9-methyl-2-phenylpurin-6-amine
CID 121009217
5-phenyl-[1,2,5]oxadiazolo[3,4-b]pyrazine
CID 588207
5-phenyl-3-(5-phenyl-1,2,4-oxadiazol-3-yl)pyrazin-2-amine
CID 175019956
(7S)-7-methyl-2-phenyl-6,7,8,9-tetrahydrobenzo[g]pteridin-4-amine
CID 129404127
4-[2-(4-aminophenyl)-6-phenylpyrimidin-4-yl]aniline
CID 630837
4-(4,6-diphenylpyrimidin-2-yl)aniline
CID 629613
6-phenyl-1,3,5-triazine-2,4-diamine;thiourea
CID 87330411

Frequently Asked Questions

What is the IUPAC name of 2,6-diphenylpteridin-4-amine?
The IUPAC name of 2,6-diphenylpteridin-4-amine (CID 15313166) is 2,6-diphenylpteridin-4-amine.
What is the SMILES notation for 2,6-diphenylpteridin-4-amine?
The canonical SMILES for 2,6-diphenylpteridin-4-amine is Nc1nc(-c2ccccc2)nc2ncc(-c3ccccc3)nc12.
What is the InChIKey of 2,6-diphenylpteridin-4-amine?
The InChIKey is PBDIBKDFKRLTMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13N5/c19-16-15-18(23-17(22-16)13-9-5-2-6-10-13)20-11-14(21-15)12-7-3-1-4-8-12/h1-11H,(H2,19,20,22,23).
What are the key properties of 2,6-diphenylpteridin-4-amine?
2,6-diphenylpteridin-4-amine has a molecular weight of 299.34 g/mol, XLogP of 3.34, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-diphenylpteridin-4-amine is sourced from PubChem (CID 15313166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).