4-(aminomethyl)-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine

C8H14N6 — CID 130568346

IUPAC4-(aminomethyl)-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine
SMILESNCc1nc(N)nc(N2CCCC2)n1
InChIInChI=1S/C8H14N6/c9-5-6-11-7(10)13-8(12-6)14-3-1-2-4-14/h1-5,9H2,(H2,10,11,12,13)
InChIKeyAXQKREIRJYETEC-UHFFFAOYSA-N
MW194.24 g/mol
LogP-0.49
Rot. Bonds2

About 4-(aminomethyl)-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine

4-(aminomethyl)-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine (PubChem CID 130568346) has the molecular formula C8H14N6 and a molecular weight of 194.24 g/mol. Its IUPAC name is 4-(aminomethyl)-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-(aminomethyl)-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine
PubChem CID130568346
Molecular FormulaC8H14N6
Molecular Weight194.24 g/mol
Exact Mass194.13
IUPAC Name4-(aminomethyl)-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine
SMILESNCc1nc(N)nc(N2CCCC2)n1
InChIInChI=1S/C8H14N6/c9-5-6-11-7(10)13-8(12-6)14-3-1-2-4-14/h1-5,9H2,(H2,10,11,12,13)
InChIKeyAXQKREIRJYETEC-UHFFFAOYSA-N
XLogP-0.49
TPSA93.95 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.24
LogP ≤ 5-0.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-(aminomethyl)-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine?
The IUPAC name of 4-(aminomethyl)-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine (CID 130568346) is 4-(aminomethyl)-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-(aminomethyl)-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine?
The canonical SMILES for 4-(aminomethyl)-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine is NCc1nc(N)nc(N2CCCC2)n1.
What is the InChIKey of 4-(aminomethyl)-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine?
The InChIKey is AXQKREIRJYETEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N6/c9-5-6-11-7(10)13-8(12-6)14-3-1-2-4-14/h1-5,9H2,(H2,10,11,12,13).
What are the key properties of 4-(aminomethyl)-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine?
4-(aminomethyl)-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine has a molecular weight of 194.24 g/mol, XLogP of -0.49, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(aminomethyl)-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine is sourced from PubChem (CID 130568346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).