N-methylpteridin-2-amine

C7H7N5 — CID 23422100

IUPACN-methylpteridin-2-amine
SMILESCNc1ncc2nccnc2n1
InChIInChI=1S/C7H7N5/c1-8-7-11-4-5-6(12-7)10-3-2-9-5/h2-4H,1H3,(H,8,10,11,12)
InChIKeyFCJSISFRKUULPL-UHFFFAOYSA-N
MW161.17 g/mol
LogP0.46
Rot. Bonds1

About N-methylpteridin-2-amine

N-methylpteridin-2-amine (PubChem CID 23422100) has the molecular formula C7H7N5 and a molecular weight of 161.17 g/mol. Its IUPAC name is N-methylpteridin-2-amine.

Molecular Properties

Compound NameN-methylpteridin-2-amine
PubChem CID23422100
Molecular FormulaC7H7N5
Molecular Weight161.17 g/mol
Exact Mass161.07
IUPAC NameN-methylpteridin-2-amine
SMILESCNc1ncc2nccnc2n1
InChIInChI=1S/C7H7N5/c1-8-7-11-4-5-6(12-7)10-3-2-9-5/h2-4H,1H3,(H,8,10,11,12)
InChIKeyFCJSISFRKUULPL-UHFFFAOYSA-N
XLogP0.46
TPSA63.59 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.17
LogP ≤ 50.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-methylpteridin-2-amine?
The IUPAC name of N-methylpteridin-2-amine (CID 23422100) is N-methylpteridin-2-amine.
What is the SMILES notation for N-methylpteridin-2-amine?
The canonical SMILES for N-methylpteridin-2-amine is CNc1ncc2nccnc2n1.
What is the InChIKey of N-methylpteridin-2-amine?
The InChIKey is FCJSISFRKUULPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7N5/c1-8-7-11-4-5-6(12-7)10-3-2-9-5/h2-4H,1H3,(H,8,10,11,12).
What are the key properties of N-methylpteridin-2-amine?
N-methylpteridin-2-amine has a molecular weight of 161.17 g/mol, XLogP of 0.46, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methylpteridin-2-amine is sourced from PubChem (CID 23422100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).