1-acetyl-N-[2-hydroxy-3-(2-oxo-1-pyridinyl)propyl]piperidine-4-carboxamide

C16H23N3O4 — CID 90624817

IUPAC1-acetyl-N-[2-hydroxy-3-(2-oxo-1-pyridinyl)propyl]piperidine-4-carboxamide
SMILESCC(=O)N1CCC(C(=O)NCC(O)Cn2ccccc2=O)CC1
InChIInChI=1S/C16H23N3O4/c1-12(20)18-8-5-13(6-9-18)16(23)17-10-14(21)11-19-7-3-2-4-15(19)22/h2-4,7,13-14,21H,5-6,8-11H2,1H3,(H,17,23)
InChIKeyCOGHDVLNVALVNM-UHFFFAOYSA-N
MW321.38 g/mol
LogP-0.42
Rot. Bonds5

About 1-acetyl-N-[2-hydroxy-3-(2-oxo-1-pyridinyl)propyl]piperidine-4-carboxamide

1-acetyl-N-[2-hydroxy-3-(2-oxo-1-pyridinyl)propyl]piperidine-4-carboxamide (PubChem CID 90624817) has the molecular formula C16H23N3O4 and a molecular weight of 321.38 g/mol. Its IUPAC name is 1-acetyl-N-[2-hydroxy-3-(2-oxo-1-pyridinyl)propyl]piperidine-4-carboxamide.

Molecular Properties

Compound Name1-acetyl-N-[2-hydroxy-3-(2-oxo-1-pyridinyl)propyl]piperidine-4-carboxamide
PubChem CID90624817
Molecular FormulaC16H23N3O4
Molecular Weight321.38 g/mol
Exact Mass321.17
IUPAC Name1-acetyl-N-[2-hydroxy-3-(2-oxo-1-pyridinyl)propyl]piperidine-4-carboxamide
SMILESCC(=O)N1CCC(C(=O)NCC(O)Cn2ccccc2=O)CC1
InChIInChI=1S/C16H23N3O4/c1-12(20)18-8-5-13(6-9-18)16(23)17-10-14(21)11-19-7-3-2-4-15(19)22/h2-4,7,13-14,21H,5-6,8-11H2,1H3,(H,17,23)
InChIKeyCOGHDVLNVALVNM-UHFFFAOYSA-N
XLogP-0.42
TPSA91.64 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.38
LogP ≤ 5-0.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-hydroxy-3-(2-oxo-1-pyridinyl)propyl]cyclohex-3-ene-1-carboxamide
CID 90624993
N-[2-hydroxy-3-(2-oxo-1-pyridinyl)propyl]-5-oxopyrrolidine-2-carboxamide
CID 90624780
2-cyclopentyl-N-[(2S)-2-hydroxy-3-(2-oxo-1-pyridinyl)propyl]acetamide
CID 97428898
1-[2-hydroxy-3-(2-oxo-1-pyridinyl)propyl]-3-propan-2-ylurea
CID 90625121
4-ethyl-N-[2-hydroxy-3-(2-oxo-1-pyridinyl)propyl]-2,3-dioxopiperazine-1-carboxamide
CID 90625137
2-cyclohexyl-N-[2-hydroxy-3-(2-oxo-1-pyridinyl)propyl]acetamide
CID 90624833
1-(3,4-dimethylphenyl)-N-[2-hydroxy-3-(2-oxo-1-pyridinyl)propyl]-5-oxopyrrolidine-3-carboxamide
CID 90624944
2-chloro-N-[2-hydroxy-3-(2-oxo-1-pyridinyl)propyl]acetamide
CID 90624843
1-acetyl-N-(2-hydroxypropyl)piperidine-4-carboxamide
CID 43392752
(E)-N-[2-hydroxy-3-(2-oxo-1-pyridinyl)propyl]but-2-enamide
CID 90624837
N-[(2S)-2-hydroxy-3-(2-oxo-1-pyridinyl)propyl]-2-phenylacetamide
CID 99903624
1-(3-bromophenyl)-N-[2-hydroxy-3-(2-oxo-1-pyridinyl)propyl]-5-oxopyrrolidine-3-carboxamide
CID 90624813

Frequently Asked Questions

What is the IUPAC name of 1-acetyl-N-[2-hydroxy-3-(2-oxo-1-pyridinyl)propyl]piperidine-4-carboxamide?
The IUPAC name of 1-acetyl-N-[2-hydroxy-3-(2-oxo-1-pyridinyl)propyl]piperidine-4-carboxamide (CID 90624817) is 1-acetyl-N-[2-hydroxy-3-(2-oxo-1-pyridinyl)propyl]piperidine-4-carboxamide.
What is the SMILES notation for 1-acetyl-N-[2-hydroxy-3-(2-oxo-1-pyridinyl)propyl]piperidine-4-carboxamide?
The canonical SMILES for 1-acetyl-N-[2-hydroxy-3-(2-oxo-1-pyridinyl)propyl]piperidine-4-carboxamide is CC(=O)N1CCC(C(=O)NCC(O)Cn2ccccc2=O)CC1.
What is the InChIKey of 1-acetyl-N-[2-hydroxy-3-(2-oxo-1-pyridinyl)propyl]piperidine-4-carboxamide?
The InChIKey is COGHDVLNVALVNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O4/c1-12(20)18-8-5-13(6-9-18)16(23)17-10-14(21)11-19-7-3-2-4-15(19)22/h2-4,7,13-14,21H,5-6,8-11H2,1H3,(H,17,23).
What are the key properties of 1-acetyl-N-[2-hydroxy-3-(2-oxo-1-pyridinyl)propyl]piperidine-4-carboxamide?
1-acetyl-N-[2-hydroxy-3-(2-oxo-1-pyridinyl)propyl]piperidine-4-carboxamide has a molecular weight of 321.38 g/mol, XLogP of -0.42, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-acetyl-N-[2-hydroxy-3-(2-oxo-1-pyridinyl)propyl]piperidine-4-carboxamide is sourced from PubChem (CID 90624817), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).