7-ethylpteridin-2-amine

C8H9N5 — CID 167106574

IUPAC7-ethylpteridin-2-amine
SMILESCCc1cnc2cnc(N)nc2n1
InChIInChI=1S/C8H9N5/c1-2-5-3-10-6-4-11-8(9)13-7(6)12-5/h3-4H,2H2,1H3,(H2,9,11,12,13)
InChIKeyMKZGPULIXQFCEZ-UHFFFAOYSA-N
MW175.19 g/mol
LogP0.56
Rot. Bonds1

About 7-ethylpteridin-2-amine

7-ethylpteridin-2-amine (PubChem CID 167106574) has the molecular formula C8H9N5 and a molecular weight of 175.19 g/mol. Its IUPAC name is 7-ethylpteridin-2-amine.

Molecular Properties

Compound Name7-ethylpteridin-2-amine
PubChem CID167106574
Molecular FormulaC8H9N5
Molecular Weight175.19 g/mol
Exact Mass175.09
IUPAC Name7-ethylpteridin-2-amine
SMILESCCc1cnc2cnc(N)nc2n1
InChIInChI=1S/C8H9N5/c1-2-5-3-10-6-4-11-8(9)13-7(6)12-5/h3-4H,2H2,1H3,(H2,9,11,12,13)
InChIKeyMKZGPULIXQFCEZ-UHFFFAOYSA-N
XLogP0.56
TPSA77.58 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.19
LogP ≤ 50.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 7-ethylpteridin-2-amine?
The IUPAC name of 7-ethylpteridin-2-amine (CID 167106574) is 7-ethylpteridin-2-amine.
What is the SMILES notation for 7-ethylpteridin-2-amine?
The canonical SMILES for 7-ethylpteridin-2-amine is CCc1cnc2cnc(N)nc2n1.
What is the InChIKey of 7-ethylpteridin-2-amine?
The InChIKey is MKZGPULIXQFCEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N5/c1-2-5-3-10-6-4-11-8(9)13-7(6)12-5/h3-4H,2H2,1H3,(H2,9,11,12,13).
What are the key properties of 7-ethylpteridin-2-amine?
7-ethylpteridin-2-amine has a molecular weight of 175.19 g/mol, XLogP of 0.56, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-ethylpteridin-2-amine is sourced from PubChem (CID 167106574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).