4-cyclohexyl-6-(oxolan-2-ylmethyl)-1,3,5-triazin-2-amine

C14H22N4O — CID 63868890

IUPAC4-cyclohexyl-6-(oxolan-2-ylmethyl)-1,3,5-triazin-2-amine
SMILESNc1nc(CC2CCCO2)nc(C2CCCCC2)n1
InChIInChI=1S/C14H22N4O/c15-14-17-12(9-11-7-4-8-19-11)16-13(18-14)10-5-2-1-3-6-10/h10-11H,1-9H2,(H2,15,16,17,18)
InChIKeyWMRGYTCRDHPVMD-UHFFFAOYSA-N
MW262.36 g/mol
LogP2.22
Rot. Bonds3

About 4-cyclohexyl-6-(oxolan-2-ylmethyl)-1,3,5-triazin-2-amine

4-cyclohexyl-6-(oxolan-2-ylmethyl)-1,3,5-triazin-2-amine (PubChem CID 63868890) has the molecular formula C14H22N4O and a molecular weight of 262.36 g/mol. Its IUPAC name is 4-cyclohexyl-6-(oxolan-2-ylmethyl)-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-cyclohexyl-6-(oxolan-2-ylmethyl)-1,3,5-triazin-2-amine
PubChem CID63868890
Molecular FormulaC14H22N4O
Molecular Weight262.36 g/mol
Exact Mass262.18
IUPAC Name4-cyclohexyl-6-(oxolan-2-ylmethyl)-1,3,5-triazin-2-amine
SMILESNc1nc(CC2CCCO2)nc(C2CCCCC2)n1
InChIInChI=1S/C14H22N4O/c15-14-17-12(9-11-7-4-8-19-11)16-13(18-14)10-5-2-1-3-6-10/h10-11H,1-9H2,(H2,15,16,17,18)
InChIKeyWMRGYTCRDHPVMD-UHFFFAOYSA-N
XLogP2.22
TPSA73.92 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.36
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-Cyclohexyl-6-[2-(2,2,2-trifluoroethoxy)ethyl]-1,3,5-triazin-2-amine
CID 103151165
4-Cyclohexyl-6-[2-(2,2-difluoroethoxy)ethyl]-1,3,5-triazin-2-amine
CID 103151166
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-Cyclopropyl-6-(oxolan-2-ylmethyl)-1,3,5-triazin-2-amine
CID 63867613
4-Tert-butyl-6-(oxolan-2-ylmethyl)-1,3,5-triazin-2-amine
CID 63868348
4-Ethyl-6-(oxolan-2-ylmethyl)-1,3,5-triazin-2-amine
CID 63868461
4-Cyclohexyl-6-(2-methoxyethyl)-1,3,5-triazin-2-amine
CID 63868494
4-Methyl-6-(oxolan-2-ylmethyl)-1,3,5-triazin-2-amine
CID 63868708
4-(Oxolan-2-ylmethyl)-6-propyl-1,3,5-triazin-2-amine
CID 63868726
4-Methyl-6-(7-oxabicyclo[2.2.1]heptan-2-yl)-1,3,5-triazin-2-amine
CID 64187505

Frequently Asked Questions

What is the IUPAC name of 4-cyclohexyl-6-(oxolan-2-ylmethyl)-1,3,5-triazin-2-amine?
The IUPAC name of 4-cyclohexyl-6-(oxolan-2-ylmethyl)-1,3,5-triazin-2-amine (CID 63868890) is 4-cyclohexyl-6-(oxolan-2-ylmethyl)-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-cyclohexyl-6-(oxolan-2-ylmethyl)-1,3,5-triazin-2-amine?
The canonical SMILES for 4-cyclohexyl-6-(oxolan-2-ylmethyl)-1,3,5-triazin-2-amine is Nc1nc(CC2CCCO2)nc(C2CCCCC2)n1.
What is the InChIKey of 4-cyclohexyl-6-(oxolan-2-ylmethyl)-1,3,5-triazin-2-amine?
The InChIKey is WMRGYTCRDHPVMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O/c15-14-17-12(9-11-7-4-8-19-11)16-13(18-14)10-5-2-1-3-6-10/h10-11H,1-9H2,(H2,15,16,17,18).
What are the key properties of 4-cyclohexyl-6-(oxolan-2-ylmethyl)-1,3,5-triazin-2-amine?
4-cyclohexyl-6-(oxolan-2-ylmethyl)-1,3,5-triazin-2-amine has a molecular weight of 262.36 g/mol, XLogP of 2.22, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclohexyl-6-(oxolan-2-ylmethyl)-1,3,5-triazin-2-amine is sourced from PubChem (CID 63868890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).