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

C7H10N4O — CID 65329517

IUPAC4-(oxolan-3-yl)-1,3,5-triazin-2-amine
SMILESNc1ncnc(C2CCOC2)n1
InChIInChI=1S/C7H10N4O/c8-7-10-4-9-6(11-7)5-1-2-12-3-5/h4-5H,1-3H2,(H2,8,9,10,11)
InChIKeyIHDABYPQRBFLGA-UHFFFAOYSA-N
MW166.18 g/mol
LogP-0.04
Rot. Bonds1

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

4-(oxolan-3-yl)-1,3,5-triazin-2-amine (PubChem CID 65329517) has the molecular formula C7H10N4O and a molecular weight of 166.18 g/mol. Its IUPAC name is 4-(oxolan-3-yl)-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-(oxolan-3-yl)-1,3,5-triazin-2-amine
PubChem CID65329517
Molecular FormulaC7H10N4O
Molecular Weight166.18 g/mol
Exact Mass166.09
IUPAC Name4-(oxolan-3-yl)-1,3,5-triazin-2-amine
SMILESNc1ncnc(C2CCOC2)n1
InChIInChI=1S/C7H10N4O/c8-7-10-4-9-6(11-7)5-1-2-12-3-5/h4-5H,1-3H2,(H2,8,9,10,11)
InChIKeyIHDABYPQRBFLGA-UHFFFAOYSA-N
XLogP-0.04
TPSA73.92 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.18
LogP ≤ 5-0.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-(2-Methoxyethyl)-1,3,5-triazin-2-amine
CID 63868455
6-(Oxolan-3-yl)-1,3,5-triazine-2,4-diamine
CID 112681588
4-(Oxetan-3-yl)-1,3,5-triazin-2-amine
CID 153931289
4-(3-Methoxypropyl)-1,3,5-triazin-2-amine
CID 65093594
4-Methyl-6-(oxolan-3-yl)-1,3,5-triazin-2-amine
CID 65329516
4-Ethyl-6-(oxolan-3-yl)-1,3,5-triazin-2-amine
CID 65329570
4-(Oxolan-3-yl)-6-propyl-1,3,5-triazin-2-amine
CID 65329571
4-(Oxolan-3-yl)-6-propan-2-yl-1,3,5-triazin-2-amine
CID 65329572
4-Cyclopropyl-6-(oxolan-3-yl)-1,3,5-triazin-2-amine
CID 65329573
4-Tert-butyl-6-(oxolan-3-yl)-1,3,5-triazin-2-amine
CID 65329624
4-(4-Tetrahydropyranyl)-1,3,5-triazin-2-amine
CID 65334318
4-Chloro-6-(oxolan-3-yl)-1,3,5-triazin-2-amine
CID 83241128

Frequently Asked Questions

What is the IUPAC name of 4-(oxolan-3-yl)-1,3,5-triazin-2-amine?
The IUPAC name of 4-(oxolan-3-yl)-1,3,5-triazin-2-amine (CID 65329517) is 4-(oxolan-3-yl)-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-(oxolan-3-yl)-1,3,5-triazin-2-amine?
The canonical SMILES for 4-(oxolan-3-yl)-1,3,5-triazin-2-amine is Nc1ncnc(C2CCOC2)n1.
What is the InChIKey of 4-(oxolan-3-yl)-1,3,5-triazin-2-amine?
The InChIKey is IHDABYPQRBFLGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N4O/c8-7-10-4-9-6(11-7)5-1-2-12-3-5/h4-5H,1-3H2,(H2,8,9,10,11).
What are the key properties of 4-(oxolan-3-yl)-1,3,5-triazin-2-amine?
4-(oxolan-3-yl)-1,3,5-triazin-2-amine has a molecular weight of 166.18 g/mol, XLogP of -0.04, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(oxolan-3-yl)-1,3,5-triazin-2-amine is sourced from PubChem (CID 65329517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).