5-amino-1-[3-[2-(2-hydroxyethyl)piperidin-1-yl]propyl]pyridin-2-one

C15H25N3O2 — CID 43259597

IUPAC5-amino-1-[3-[2-(2-hydroxyethyl)piperidin-1-yl]propyl]pyridin-2-one
SMILESNc1ccc(=O)n(CCCN2CCCCC2CCO)c1
InChIInChI=1S/C15H25N3O2/c16-13-5-6-15(20)18(12-13)10-3-9-17-8-2-1-4-14(17)7-11-19/h5-6,12,14,19H,1-4,7-11,16H2
InChIKeyAKZXIHHZXOPMMM-UHFFFAOYSA-N
MW279.38 g/mol
LogP1.06
Rot. Bonds6

About 5-amino-1-[3-[2-(2-hydroxyethyl)piperidin-1-yl]propyl]pyridin-2-one

5-amino-1-[3-[2-(2-hydroxyethyl)piperidin-1-yl]propyl]pyridin-2-one (PubChem CID 43259597) has the molecular formula C15H25N3O2 and a molecular weight of 279.38 g/mol. Its IUPAC name is 5-amino-1-[3-[2-(2-hydroxyethyl)piperidin-1-yl]propyl]pyridin-2-one.

Molecular Properties

Compound Name5-amino-1-[3-[2-(2-hydroxyethyl)piperidin-1-yl]propyl]pyridin-2-one
PubChem CID43259597
Molecular FormulaC15H25N3O2
Molecular Weight279.38 g/mol
Exact Mass279.19
IUPAC Name5-amino-1-[3-[2-(2-hydroxyethyl)piperidin-1-yl]propyl]pyridin-2-one
SMILESNc1ccc(=O)n(CCCN2CCCCC2CCO)c1
InChIInChI=1S/C15H25N3O2/c16-13-5-6-15(20)18(12-13)10-3-9-17-8-2-1-4-14(17)7-11-19/h5-6,12,14,19H,1-4,7-11,16H2
InChIKeyAKZXIHHZXOPMMM-UHFFFAOYSA-N
XLogP1.06
TPSA71.49 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.38
LogP ≤ 51.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-amino-1-[3-[2-(2-hydroxyethyl)piperidin-1-yl]propyl]pyridin-2-one?
The IUPAC name of 5-amino-1-[3-[2-(2-hydroxyethyl)piperidin-1-yl]propyl]pyridin-2-one (CID 43259597) is 5-amino-1-[3-[2-(2-hydroxyethyl)piperidin-1-yl]propyl]pyridin-2-one.
What is the SMILES notation for 5-amino-1-[3-[2-(2-hydroxyethyl)piperidin-1-yl]propyl]pyridin-2-one?
The canonical SMILES for 5-amino-1-[3-[2-(2-hydroxyethyl)piperidin-1-yl]propyl]pyridin-2-one is Nc1ccc(=O)n(CCCN2CCCCC2CCO)c1.
What is the InChIKey of 5-amino-1-[3-[2-(2-hydroxyethyl)piperidin-1-yl]propyl]pyridin-2-one?
The InChIKey is AKZXIHHZXOPMMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O2/c16-13-5-6-15(20)18(12-13)10-3-9-17-8-2-1-4-14(17)7-11-19/h5-6,12,14,19H,1-4,7-11,16H2.
What are the key properties of 5-amino-1-[3-[2-(2-hydroxyethyl)piperidin-1-yl]propyl]pyridin-2-one?
5-amino-1-[3-[2-(2-hydroxyethyl)piperidin-1-yl]propyl]pyridin-2-one has a molecular weight of 279.38 g/mol, XLogP of 1.06, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-1-[3-[2-(2-hydroxyethyl)piperidin-1-yl]propyl]pyridin-2-one is sourced from PubChem (CID 43259597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).