4-cyclopropyl-6-(oxolan-3-yl)-1,3,5-triazin-2-amine

C10H14N4O — CID 65329573

IUPAC4-cyclopropyl-6-(oxolan-3-yl)-1,3,5-triazin-2-amine
SMILESNc1nc(C2CC2)nc(C2CCOC2)n1
InChIInChI=1S/C10H14N4O/c11-10-13-8(6-1-2-6)12-9(14-10)7-3-4-15-5-7/h6-7H,1-5H2,(H2,11,12,13,14)
InChIKeyHCEPXMDNEMAVBV-UHFFFAOYSA-N
MW206.25 g/mol
LogP0.84
Rot. Bonds2

About 4-cyclopropyl-6-(oxolan-3-yl)-1,3,5-triazin-2-amine

4-cyclopropyl-6-(oxolan-3-yl)-1,3,5-triazin-2-amine (PubChem CID 65329573) has the molecular formula C10H14N4O and a molecular weight of 206.25 g/mol. Its IUPAC name is 4-cyclopropyl-6-(oxolan-3-yl)-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-cyclopropyl-6-(oxolan-3-yl)-1,3,5-triazin-2-amine
PubChem CID65329573
Molecular FormulaC10H14N4O
Molecular Weight206.25 g/mol
Exact Mass206.12
IUPAC Name4-cyclopropyl-6-(oxolan-3-yl)-1,3,5-triazin-2-amine
SMILESNc1nc(C2CC2)nc(C2CCOC2)n1
InChIInChI=1S/C10H14N4O/c11-10-13-8(6-1-2-6)12-9(14-10)7-3-4-15-5-7/h6-7H,1-5H2,(H2,11,12,13,14)
InChIKeyHCEPXMDNEMAVBV-UHFFFAOYSA-N
XLogP0.84
TPSA73.92 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.25
LogP ≤ 50.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-cyclopropyl-6-(oxolan-3-yl)-1,3,5-triazin-2-amine?
The IUPAC name of 4-cyclopropyl-6-(oxolan-3-yl)-1,3,5-triazin-2-amine (CID 65329573) is 4-cyclopropyl-6-(oxolan-3-yl)-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-cyclopropyl-6-(oxolan-3-yl)-1,3,5-triazin-2-amine?
The canonical SMILES for 4-cyclopropyl-6-(oxolan-3-yl)-1,3,5-triazin-2-amine is Nc1nc(C2CC2)nc(C2CCOC2)n1.
What is the InChIKey of 4-cyclopropyl-6-(oxolan-3-yl)-1,3,5-triazin-2-amine?
The InChIKey is HCEPXMDNEMAVBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4O/c11-10-13-8(6-1-2-6)12-9(14-10)7-3-4-15-5-7/h6-7H,1-5H2,(H2,11,12,13,14).
What are the key properties of 4-cyclopropyl-6-(oxolan-3-yl)-1,3,5-triazin-2-amine?
4-cyclopropyl-6-(oxolan-3-yl)-1,3,5-triazin-2-amine has a molecular weight of 206.25 g/mol, XLogP of 0.84, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopropyl-6-(oxolan-3-yl)-1,3,5-triazin-2-amine is sourced from PubChem (CID 65329573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).