5-hydroxy-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]pentanamide

C13H25N3O3 — CID 79199132

IUPAC5-hydroxy-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]pentanamide
SMILESCNC(=O)CN1CCC(NC(=O)CCCCO)CC1
InChIInChI=1S/C13H25N3O3/c1-14-13(19)10-16-7-5-11(6-8-16)15-12(18)4-2-3-9-17/h11,17H,2-10H2,1H3,(H,14,19)(H,15,18)
InChIKeyGJDWORGYVSFZAT-UHFFFAOYSA-N
MW271.36 g/mol
LogP-0.52
Rot. Bonds7

About 5-hydroxy-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]pentanamide

5-hydroxy-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]pentanamide (PubChem CID 79199132) has the molecular formula C13H25N3O3 and a molecular weight of 271.36 g/mol. Its IUPAC name is 5-hydroxy-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]pentanamide.

Molecular Properties

Compound Name5-hydroxy-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]pentanamide
PubChem CID79199132
Molecular FormulaC13H25N3O3
Molecular Weight271.36 g/mol
Exact Mass271.19
IUPAC Name5-hydroxy-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]pentanamide
SMILESCNC(=O)CN1CCC(NC(=O)CCCCO)CC1
InChIInChI=1S/C13H25N3O3/c1-14-13(19)10-16-7-5-11(6-8-16)15-12(18)4-2-3-9-17/h11,17H,2-10H2,1H3,(H,14,19)(H,15,18)
InChIKeyGJDWORGYVSFZAT-UHFFFAOYSA-N
XLogP-0.52
TPSA81.67 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.36
LogP ≤ 5-0.52
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 5-hydroxy-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]pentanamide?
The IUPAC name of 5-hydroxy-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]pentanamide (CID 79199132) is 5-hydroxy-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]pentanamide.
What is the SMILES notation for 5-hydroxy-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]pentanamide?
The canonical SMILES for 5-hydroxy-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]pentanamide is CNC(=O)CN1CCC(NC(=O)CCCCO)CC1.
What is the InChIKey of 5-hydroxy-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]pentanamide?
The InChIKey is GJDWORGYVSFZAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O3/c1-14-13(19)10-16-7-5-11(6-8-16)15-12(18)4-2-3-9-17/h11,17H,2-10H2,1H3,(H,14,19)(H,15,18).
What are the key properties of 5-hydroxy-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]pentanamide?
5-hydroxy-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]pentanamide has a molecular weight of 271.36 g/mol, XLogP of -0.52, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydroxy-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]pentanamide is sourced from PubChem (CID 79199132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).