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

C12H18N4O — CID 65330263

IUPAC4-cyclopentyl-6-(oxolan-2-yl)-1,3,5-triazin-2-amine
SMILESNc1nc(C2CCCC2)nc(C2CCCO2)n1
InChIInChI=1S/C12H18N4O/c13-12-15-10(8-4-1-2-5-8)14-11(16-12)9-6-3-7-17-9/h8-9H,1-7H2,(H2,13,14,15,16)
InChIKeyWSBLVJWOSIWENV-UHFFFAOYSA-N
MW234.30 g/mol
LogP1.96
Rot. Bonds2

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

4-cyclopentyl-6-(oxolan-2-yl)-1,3,5-triazin-2-amine (PubChem CID 65330263) has the molecular formula C12H18N4O and a molecular weight of 234.30 g/mol. Its IUPAC name is 4-cyclopentyl-6-(oxolan-2-yl)-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-cyclopentyl-6-(oxolan-2-yl)-1,3,5-triazin-2-amine
PubChem CID65330263
Molecular FormulaC12H18N4O
Molecular Weight234.30 g/mol
Exact Mass234.15
IUPAC Name4-cyclopentyl-6-(oxolan-2-yl)-1,3,5-triazin-2-amine
SMILESNc1nc(C2CCCC2)nc(C2CCCO2)n1
InChIInChI=1S/C12H18N4O/c13-12-15-10(8-4-1-2-5-8)14-11(16-12)9-6-3-7-17-9/h8-9H,1-7H2,(H2,13,14,15,16)
InChIKeyWSBLVJWOSIWENV-UHFFFAOYSA-N
XLogP1.96
TPSA73.92 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 4-cyclopentyl-6-(oxolan-2-yl)-1,3,5-triazin-2-amine with MolForge

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Related Compounds

1,3,5-Triazine-2,4-diamine, 6-(tetrahydro-2-furanyl)-
CID 135627
4-Cyclopentyl-6-(oxolan-2-ylmethyl)-1,3,5-triazin-2-amine
CID 55251401
4-Cyclopentyl-6-(methoxymethyl)-1,3,5-triazin-2-amine
CID 63868622
4-Cyclopentyl-6-(propoxymethyl)-1,3,5-triazin-2-amine
CID 63868624
4-Cyclopentyl-6-(1-ethoxyethyl)-1,3,5-triazin-2-amine
CID 64535261
4-Cyclohexyl-6-(1-ethoxyethyl)-1,3,5-triazin-2-amine
CID 64535262
4-Cyclopentyl-6-(oxolan-3-yl)-1,3,5-triazin-2-amine
CID 65329625
4-Methyl-6-(oxolan-2-yl)-1,3,5-triazin-2-amine
CID 65330153
4-Ethyl-6-(oxolan-2-yl)-1,3,5-triazin-2-amine
CID 65330205
4-(Oxolan-2-yl)-6-propyl-1,3,5-triazin-2-amine
CID 65330206
4-(Oxolan-2-yl)-6-propan-2-yl-1,3,5-triazin-2-amine
CID 65330207
4-Cyclopropyl-6-(oxolan-2-yl)-1,3,5-triazin-2-amine
CID 65330208

Frequently Asked Questions

What is the IUPAC name of 4-cyclopentyl-6-(oxolan-2-yl)-1,3,5-triazin-2-amine?
The IUPAC name of 4-cyclopentyl-6-(oxolan-2-yl)-1,3,5-triazin-2-amine (CID 65330263) is 4-cyclopentyl-6-(oxolan-2-yl)-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-cyclopentyl-6-(oxolan-2-yl)-1,3,5-triazin-2-amine?
The canonical SMILES for 4-cyclopentyl-6-(oxolan-2-yl)-1,3,5-triazin-2-amine is Nc1nc(C2CCCC2)nc(C2CCCO2)n1.
What is the InChIKey of 4-cyclopentyl-6-(oxolan-2-yl)-1,3,5-triazin-2-amine?
The InChIKey is WSBLVJWOSIWENV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4O/c13-12-15-10(8-4-1-2-5-8)14-11(16-12)9-6-3-7-17-9/h8-9H,1-7H2,(H2,13,14,15,16).
What are the key properties of 4-cyclopentyl-6-(oxolan-2-yl)-1,3,5-triazin-2-amine?
4-cyclopentyl-6-(oxolan-2-yl)-1,3,5-triazin-2-amine has a molecular weight of 234.30 g/mol, XLogP of 1.96, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopentyl-6-(oxolan-2-yl)-1,3,5-triazin-2-amine is sourced from PubChem (CID 65330263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).