1-[1-[6-(ethylamino)-5-methoxypyrimidin-4-yl]piperidin-4-yl]ethanol

C14H24N4O2 — CID 106839920

IUPAC1-[1-[6-(ethylamino)-5-methoxypyrimidin-4-yl]piperidin-4-yl]ethanol
SMILESCCNc1ncnc(N2CCC(C(C)O)CC2)c1OC
InChIInChI=1S/C14H24N4O2/c1-4-15-13-12(20-3)14(17-9-16-13)18-7-5-11(6-8-18)10(2)19/h9-11,19H,4-8H2,1-3H3,(H,15,16,17)
InChIKeyYPJHFNCCTLYTDU-UHFFFAOYSA-N
MW280.37 g/mol
LogP1.51
Rot. Bonds5

About 1-[1-[6-(ethylamino)-5-methoxypyrimidin-4-yl]piperidin-4-yl]ethanol

1-[1-[6-(ethylamino)-5-methoxypyrimidin-4-yl]piperidin-4-yl]ethanol (PubChem CID 106839920) has the molecular formula C14H24N4O2 and a molecular weight of 280.37 g/mol. Its IUPAC name is 1-[1-[6-(ethylamino)-5-methoxypyrimidin-4-yl]piperidin-4-yl]ethanol.

Molecular Properties

Compound Name1-[1-[6-(ethylamino)-5-methoxypyrimidin-4-yl]piperidin-4-yl]ethanol
PubChem CID106839920
Molecular FormulaC14H24N4O2
Molecular Weight280.37 g/mol
Exact Mass280.19
IUPAC Name1-[1-[6-(ethylamino)-5-methoxypyrimidin-4-yl]piperidin-4-yl]ethanol
SMILESCCNc1ncnc(N2CCC(C(C)O)CC2)c1OC
InChIInChI=1S/C14H24N4O2/c1-4-15-13-12(20-3)14(17-9-16-13)18-7-5-11(6-8-18)10(2)19/h9-11,19H,4-8H2,1-3H3,(H,15,16,17)
InChIKeyYPJHFNCCTLYTDU-UHFFFAOYSA-N
XLogP1.51
TPSA70.51 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 51.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-[1-[6-(ethylamino)-5-methoxypyrimidin-4-yl]piperidin-4-yl]ethanol?
The IUPAC name of 1-[1-[6-(ethylamino)-5-methoxypyrimidin-4-yl]piperidin-4-yl]ethanol (CID 106839920) is 1-[1-[6-(ethylamino)-5-methoxypyrimidin-4-yl]piperidin-4-yl]ethanol.
What is the SMILES notation for 1-[1-[6-(ethylamino)-5-methoxypyrimidin-4-yl]piperidin-4-yl]ethanol?
The canonical SMILES for 1-[1-[6-(ethylamino)-5-methoxypyrimidin-4-yl]piperidin-4-yl]ethanol is CCNc1ncnc(N2CCC(C(C)O)CC2)c1OC.
What is the InChIKey of 1-[1-[6-(ethylamino)-5-methoxypyrimidin-4-yl]piperidin-4-yl]ethanol?
The InChIKey is YPJHFNCCTLYTDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O2/c1-4-15-13-12(20-3)14(17-9-16-13)18-7-5-11(6-8-18)10(2)19/h9-11,19H,4-8H2,1-3H3,(H,15,16,17).
What are the key properties of 1-[1-[6-(ethylamino)-5-methoxypyrimidin-4-yl]piperidin-4-yl]ethanol?
1-[1-[6-(ethylamino)-5-methoxypyrimidin-4-yl]piperidin-4-yl]ethanol has a molecular weight of 280.37 g/mol, XLogP of 1.51, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-[6-(ethylamino)-5-methoxypyrimidin-4-yl]piperidin-4-yl]ethanol is sourced from PubChem (CID 106839920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).