1-[1-(1-hydroxyethyl)piperidin-4-yl]propan-1-ol

C10H21NO2 — CID 3016715

IUPAC1-[1-(1-hydroxyethyl)piperidin-4-yl]propan-1-ol
SMILESCCC(O)C1CCN(C(C)O)CC1
InChIInChI=1S/C10H21NO2/c1-3-10(13)9-4-6-11(7-5-9)8(2)12/h8-10,12-13H,3-7H2,1-2H3
InChIKeyCPPFWJCJWMMIMV-UHFFFAOYSA-N
MW187.28 g/mol
LogP0.81
Rot. Bonds3

About 1-[1-(1-hydroxyethyl)piperidin-4-yl]propan-1-ol

1-[1-(1-hydroxyethyl)piperidin-4-yl]propan-1-ol (PubChem CID 3016715) has the molecular formula C10H21NO2 and a molecular weight of 187.28 g/mol. Its IUPAC name is 1-[1-(1-hydroxyethyl)piperidin-4-yl]propan-1-ol.

Molecular Properties

Compound Name1-[1-(1-hydroxyethyl)piperidin-4-yl]propan-1-ol
PubChem CID3016715
Molecular FormulaC10H21NO2
Molecular Weight187.28 g/mol
Exact Mass187.16
IUPAC Name1-[1-(1-hydroxyethyl)piperidin-4-yl]propan-1-ol
SMILESCCC(O)C1CCN(C(C)O)CC1
InChIInChI=1S/C10H21NO2/c1-3-10(13)9-4-6-11(7-5-9)8(2)12/h8-10,12-13H,3-7H2,1-2H3
InChIKeyCPPFWJCJWMMIMV-UHFFFAOYSA-N
XLogP0.81
TPSA43.70 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.28
LogP ≤ 50.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[1-(1-hydroxyethyl)piperidin-4-yl]propan-1-ol?
The IUPAC name of 1-[1-(1-hydroxyethyl)piperidin-4-yl]propan-1-ol (CID 3016715) is 1-[1-(1-hydroxyethyl)piperidin-4-yl]propan-1-ol.
What is the SMILES notation for 1-[1-(1-hydroxyethyl)piperidin-4-yl]propan-1-ol?
The canonical SMILES for 1-[1-(1-hydroxyethyl)piperidin-4-yl]propan-1-ol is CCC(O)C1CCN(C(C)O)CC1.
What is the InChIKey of 1-[1-(1-hydroxyethyl)piperidin-4-yl]propan-1-ol?
The InChIKey is CPPFWJCJWMMIMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO2/c1-3-10(13)9-4-6-11(7-5-9)8(2)12/h8-10,12-13H,3-7H2,1-2H3.
What are the key properties of 1-[1-(1-hydroxyethyl)piperidin-4-yl]propan-1-ol?
1-[1-(1-hydroxyethyl)piperidin-4-yl]propan-1-ol has a molecular weight of 187.28 g/mol, XLogP of 0.81, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(1-hydroxyethyl)piperidin-4-yl]propan-1-ol is sourced from PubChem (CID 3016715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).