N-(furan-2-ylmethyl)-4-methoxy-6-(4-methylpiperidin-1-yl)-1,3,5-triazin-2-amine

C15H21N5O2 — CID 648916

IUPACN-(furan-2-ylmethyl)-4-methoxy-6-(4-methylpiperidin-1-yl)-1,3,5-triazin-2-amine
SMILESCOc1nc(NCc2ccco2)nc(N2CCC(C)CC2)n1
InChIInChI=1S/C15H21N5O2/c1-11-5-7-20(8-6-11)14-17-13(18-15(19-14)21-2)16-10-12-4-3-9-22-12/h3-4,9,11H,5-8,10H2,1-2H3,(H,16,17,18,19)
InChIKeyWPZLZODROUSAMJ-UHFFFAOYSA-N
MW303.37 g/mol
LogP2.32
Rot. Bonds5

About N-(furan-2-ylmethyl)-4-methoxy-6-(4-methylpiperidin-1-yl)-1,3,5-triazin-2-amine

N-(furan-2-ylmethyl)-4-methoxy-6-(4-methylpiperidin-1-yl)-1,3,5-triazin-2-amine (PubChem CID 648916) has the molecular formula C15H21N5O2 and a molecular weight of 303.37 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-4-methoxy-6-(4-methylpiperidin-1-yl)-1,3,5-triazin-2-amine.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-4-methoxy-6-(4-methylpiperidin-1-yl)-1,3,5-triazin-2-amine
PubChem CID648916
Molecular FormulaC15H21N5O2
Molecular Weight303.37 g/mol
Exact Mass303.17
IUPAC NameN-(furan-2-ylmethyl)-4-methoxy-6-(4-methylpiperidin-1-yl)-1,3,5-triazin-2-amine
SMILESCOc1nc(NCc2ccco2)nc(N2CCC(C)CC2)n1
InChIInChI=1S/C15H21N5O2/c1-11-5-7-20(8-6-11)14-17-13(18-15(19-14)21-2)16-10-12-4-3-9-22-12/h3-4,9,11H,5-8,10H2,1-2H3,(H,16,17,18,19)
InChIKeyWPZLZODROUSAMJ-UHFFFAOYSA-N
XLogP2.32
TPSA76.31 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.37
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-4-methoxy-6-(4-methylpiperidin-1-yl)-1,3,5-triazin-2-amine?
The IUPAC name of N-(furan-2-ylmethyl)-4-methoxy-6-(4-methylpiperidin-1-yl)-1,3,5-triazin-2-amine (CID 648916) is N-(furan-2-ylmethyl)-4-methoxy-6-(4-methylpiperidin-1-yl)-1,3,5-triazin-2-amine.
What is the SMILES notation for N-(furan-2-ylmethyl)-4-methoxy-6-(4-methylpiperidin-1-yl)-1,3,5-triazin-2-amine?
The canonical SMILES for N-(furan-2-ylmethyl)-4-methoxy-6-(4-methylpiperidin-1-yl)-1,3,5-triazin-2-amine is COc1nc(NCc2ccco2)nc(N2CCC(C)CC2)n1.
What is the InChIKey of N-(furan-2-ylmethyl)-4-methoxy-6-(4-methylpiperidin-1-yl)-1,3,5-triazin-2-amine?
The InChIKey is WPZLZODROUSAMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N5O2/c1-11-5-7-20(8-6-11)14-17-13(18-15(19-14)21-2)16-10-12-4-3-9-22-12/h3-4,9,11H,5-8,10H2,1-2H3,(H,16,17,18,19).
What are the key properties of N-(furan-2-ylmethyl)-4-methoxy-6-(4-methylpiperidin-1-yl)-1,3,5-triazin-2-amine?
N-(furan-2-ylmethyl)-4-methoxy-6-(4-methylpiperidin-1-yl)-1,3,5-triazin-2-amine has a molecular weight of 303.37 g/mol, XLogP of 2.32, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-4-methoxy-6-(4-methylpiperidin-1-yl)-1,3,5-triazin-2-amine is sourced from PubChem (CID 648916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).