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

C12H18N4O — CID 65329625

IUPAC4-cyclopentyl-6-(oxolan-3-yl)-1,3,5-triazin-2-amine
SMILESNc1nc(C2CCCC2)nc(C2CCOC2)n1
InChIInChI=1S/C12H18N4O/c13-12-15-10(8-3-1-2-4-8)14-11(16-12)9-5-6-17-7-9/h8-9H,1-7H2,(H2,13,14,15,16)
InChIKeyRHJVCPROUDFRPN-UHFFFAOYSA-N
MW234.30 g/mol
LogP1.62
Rot. Bonds2

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

4-cyclopentyl-6-(oxolan-3-yl)-1,3,5-triazin-2-amine (PubChem CID 65329625) has the molecular formula C12H18N4O and a molecular weight of 234.30 g/mol. Its IUPAC name is 4-cyclopentyl-6-(oxolan-3-yl)-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-cyclopentyl-6-(oxolan-3-yl)-1,3,5-triazin-2-amine
PubChem CID65329625
Molecular FormulaC12H18N4O
Molecular Weight234.30 g/mol
Exact Mass234.15
IUPAC Name4-cyclopentyl-6-(oxolan-3-yl)-1,3,5-triazin-2-amine
SMILESNc1nc(C2CCCC2)nc(C2CCOC2)n1
InChIInChI=1S/C12H18N4O/c13-12-15-10(8-3-1-2-4-8)14-11(16-12)9-5-6-17-7-9/h8-9H,1-7H2,(H2,13,14,15,16)
InChIKeyRHJVCPROUDFRPN-UHFFFAOYSA-N
XLogP1.62
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 ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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

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Related Compounds

4-Cyclopentyl-6-[2-(2,2,2-trifluoroethoxy)ethyl]-1,3,5-triazin-2-amine
CID 103151163
4-Cyclopentyl-6-[2-(2,2-difluoroethoxy)ethyl]-1,3,5-triazin-2-amine
CID 103151164
6-(Oxolan-3-yl)-1,3,5-triazine-2,4-diamine
CID 112681588
4-Cyclopentyl-6-(oxolan-2-ylmethyl)-1,3,5-triazin-2-amine
CID 55251401
4-Cycloheptyl-6-(oxolan-2-ylmethyl)-1,3,5-triazin-2-amine
CID 63866848
4-(Oxolan-2-ylmethyl)-6-propan-2-yl-1,3,5-triazin-2-amine
CID 63866982
4-Cyclopentyl-6-(2-methoxyethyl)-1,3,5-triazin-2-amine
CID 63868488
4-Cyclohexyl-6-(2-methoxyethyl)-1,3,5-triazin-2-amine
CID 63868494
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-Cyclohexyl-6-(oxolan-2-ylmethyl)-1,3,5-triazin-2-amine
CID 63868890
4-Cyclopentyl-6-(1-ethoxyethyl)-1,3,5-triazin-2-amine
CID 64535261

Frequently Asked Questions

What is the IUPAC name of 4-cyclopentyl-6-(oxolan-3-yl)-1,3,5-triazin-2-amine?
The IUPAC name of 4-cyclopentyl-6-(oxolan-3-yl)-1,3,5-triazin-2-amine (CID 65329625) is 4-cyclopentyl-6-(oxolan-3-yl)-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-cyclopentyl-6-(oxolan-3-yl)-1,3,5-triazin-2-amine?
The canonical SMILES for 4-cyclopentyl-6-(oxolan-3-yl)-1,3,5-triazin-2-amine is Nc1nc(C2CCCC2)nc(C2CCOC2)n1.
What is the InChIKey of 4-cyclopentyl-6-(oxolan-3-yl)-1,3,5-triazin-2-amine?
The InChIKey is RHJVCPROUDFRPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4O/c13-12-15-10(8-3-1-2-4-8)14-11(16-12)9-5-6-17-7-9/h8-9H,1-7H2,(H2,13,14,15,16).
What are the key properties of 4-cyclopentyl-6-(oxolan-3-yl)-1,3,5-triazin-2-amine?
4-cyclopentyl-6-(oxolan-3-yl)-1,3,5-triazin-2-amine has a molecular weight of 234.30 g/mol, XLogP of 1.62, 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-3-yl)-1,3,5-triazin-2-amine is sourced from PubChem (CID 65329625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).