pteridin-2-amine

C6H5N5 — CID 907652

IUPACpteridin-2-amine
SMILESNc1ncc2nccnc2n1
InChIInChI=1S/C6H5N5/c7-6-10-3-4-5(11-6)9-2-1-8-4/h1-3H,(H2,7,9,10,11)
InChIKeyHYCZDWGCJOEHBO-UHFFFAOYSA-N
MW147.14 g/mol
LogP0.00
Rot. Bonds

About pteridin-2-amine

pteridin-2-amine (PubChem CID 907652) has the molecular formula C6H5N5 and a molecular weight of 147.14 g/mol. Its IUPAC name is pteridin-2-amine.

Molecular Properties

Compound Namepteridin-2-amine
PubChem CID907652
Molecular FormulaC6H5N5
Molecular Weight147.14 g/mol
Exact Mass147.05
IUPAC Namepteridin-2-amine
SMILESNc1ncc2nccnc2n1
InChIInChI=1S/C6H5N5/c7-6-10-3-4-5(11-6)9-2-1-8-4/h1-3H,(H2,7,9,10,11)
InChIKeyHYCZDWGCJOEHBO-UHFFFAOYSA-N
XLogP0.00
TPSA77.58 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.14
LogP ≤ 50.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of pteridin-2-amine?
The IUPAC name of pteridin-2-amine (CID 907652) is pteridin-2-amine.
What is the SMILES notation for pteridin-2-amine?
The canonical SMILES for pteridin-2-amine is Nc1ncc2nccnc2n1.
What is the InChIKey of pteridin-2-amine?
The InChIKey is HYCZDWGCJOEHBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5N5/c7-6-10-3-4-5(11-6)9-2-1-8-4/h1-3H,(H2,7,9,10,11).
What are the key properties of pteridin-2-amine?
pteridin-2-amine has a molecular weight of 147.14 g/mol, XLogP of 0.00, 0 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for pteridin-2-amine is sourced from PubChem (CID 907652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).