1-piperidin-4-yl-2-[4-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]ethanol

C17H30N4O2 — CID 146042226

IUPAC1-piperidin-4-yl-2-[4-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]ethanol
SMILESCC(C)c1noc(C2CCN(CC(O)C3CCNCC3)CC2)n1
InChIInChI=1S/C17H30N4O2/c1-12(2)16-19-17(23-20-16)14-5-9-21(10-6-14)11-15(22)13-3-7-18-8-4-13/h12-15,18,22H,3-11H2,1-2H3
InChIKeyIAYHSVARXCWDTP-UHFFFAOYSA-N
MW322.45 g/mol
LogP1.73
Rot. Bonds5

About 1-piperidin-4-yl-2-[4-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]ethanol

1-piperidin-4-yl-2-[4-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]ethanol (PubChem CID 146042226) has the molecular formula C17H30N4O2 and a molecular weight of 322.45 g/mol. Its IUPAC name is 1-piperidin-4-yl-2-[4-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]ethanol.

Molecular Properties

Compound Name1-piperidin-4-yl-2-[4-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]ethanol
PubChem CID146042226
Molecular FormulaC17H30N4O2
Molecular Weight322.45 g/mol
Exact Mass322.24
IUPAC Name1-piperidin-4-yl-2-[4-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]ethanol
SMILESCC(C)c1noc(C2CCN(CC(O)C3CCNCC3)CC2)n1
InChIInChI=1S/C17H30N4O2/c1-12(2)16-19-17(23-20-16)14-5-9-21(10-6-14)11-15(22)13-3-7-18-8-4-13/h12-15,18,22H,3-11H2,1-2H3
InChIKeyIAYHSVARXCWDTP-UHFFFAOYSA-N
XLogP1.73
TPSA74.42 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.45
LogP ≤ 51.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-piperidin-4-yl-2-[4-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]ethanol?
The IUPAC name of 1-piperidin-4-yl-2-[4-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]ethanol (CID 146042226) is 1-piperidin-4-yl-2-[4-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]ethanol.
What is the SMILES notation for 1-piperidin-4-yl-2-[4-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]ethanol?
The canonical SMILES for 1-piperidin-4-yl-2-[4-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]ethanol is CC(C)c1noc(C2CCN(CC(O)C3CCNCC3)CC2)n1.
What is the InChIKey of 1-piperidin-4-yl-2-[4-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]ethanol?
The InChIKey is IAYHSVARXCWDTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30N4O2/c1-12(2)16-19-17(23-20-16)14-5-9-21(10-6-14)11-15(22)13-3-7-18-8-4-13/h12-15,18,22H,3-11H2,1-2H3.
What are the key properties of 1-piperidin-4-yl-2-[4-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]ethanol?
1-piperidin-4-yl-2-[4-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]ethanol has a molecular weight of 322.45 g/mol, XLogP of 1.73, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-piperidin-4-yl-2-[4-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]ethanol is sourced from PubChem (CID 146042226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).