methyl 1-(2-oxo-1H-pyridine-4-carbonyl)piperidine-4-carboxylate

C13H16N2O4 — CID 103762652

IUPACmethyl 1-(2-oxo-1H-pyridine-4-carbonyl)piperidine-4-carboxylate
SMILESCOC(=O)C1CCN(C(=O)c2cc[nH]c(=O)c2)CC1
InChIInChI=1S/C13H16N2O4/c1-19-13(18)9-3-6-15(7-4-9)12(17)10-2-5-14-11(16)8-10/h2,5,8-9H,3-4,6-7H2,1H3,(H,14,16)
InChIKeyFWEBCKVGYCYDAK-UHFFFAOYSA-N
MW264.28 g/mol
LogP0.40
Rot. Bonds2

About methyl 1-(2-oxo-1H-pyridine-4-carbonyl)piperidine-4-carboxylate

methyl 1-(2-oxo-1H-pyridine-4-carbonyl)piperidine-4-carboxylate (PubChem CID 103762652) has the molecular formula C13H16N2O4 and a molecular weight of 264.28 g/mol. Its IUPAC name is methyl 1-(2-oxo-1H-pyridine-4-carbonyl)piperidine-4-carboxylate.

Molecular Properties

Compound Namemethyl 1-(2-oxo-1H-pyridine-4-carbonyl)piperidine-4-carboxylate
PubChem CID103762652
Molecular FormulaC13H16N2O4
Molecular Weight264.28 g/mol
Exact Mass264.11
IUPAC Namemethyl 1-(2-oxo-1H-pyridine-4-carbonyl)piperidine-4-carboxylate
SMILESCOC(=O)C1CCN(C(=O)c2cc[nH]c(=O)c2)CC1
InChIInChI=1S/C13H16N2O4/c1-19-13(18)9-3-6-15(7-4-9)12(17)10-2-5-14-11(16)8-10/h2,5,8-9H,3-4,6-7H2,1H3,(H,14,16)
InChIKeyFWEBCKVGYCYDAK-UHFFFAOYSA-N
XLogP0.40
TPSA79.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.28
LogP ≤ 50.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze methyl 1-(2-oxo-1H-pyridine-4-carbonyl)piperidine-4-carboxylate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(2-oxo-1H-pyridine-4-carbonyl)piperidine-4-carboxylic acid
CID 113264935
methyl (2R)-1-(2-oxo-1H-pyridine-4-carbonyl)piperidine-2-carboxylate
CID 113257736
4-[4-(cyclopropanecarbonyl)piperazine-1-carbonyl]-1H-pyridin-2-one
CID 103763407
N-[1-(2-oxo-1H-pyridine-4-carbonyl)piperidin-4-yl]cyclopropanecarboxamide
CID 103764046
4-[4-(ethylamino)piperidine-1-carbonyl]-1H-pyridin-2-one
CID 114039612
4-(4-ethylazepane-1-carbonyl)-1H-pyridin-2-one
CID 103765578
4-[4-(2-methoxyacetyl)piperazine-1-carbonyl]-1H-pyridin-2-one
CID 103762912
methyl 1-(4-amino-3-methylbenzoyl)piperidine-4-carboxylate
CID 61041768
N-ethyl-4-(2-oxo-1H-pyridine-4-carbonyl)piperazine-1-carboxamide
CID 103762745
methyl 1-[4-(bromomethyl)benzoyl]piperidine-4-carboxylate
CID 102850825
methyl 1-(3-amino-4-chlorobenzoyl)piperidine-4-carboxylate
CID 61042064
4-[3-(1-hydroxyethyl)pyrrolidine-1-carbonyl]-1H-pyridin-2-one
CID 113364846

Frequently Asked Questions

What is the IUPAC name of methyl 1-(2-oxo-1H-pyridine-4-carbonyl)piperidine-4-carboxylate?
The IUPAC name of methyl 1-(2-oxo-1H-pyridine-4-carbonyl)piperidine-4-carboxylate (CID 103762652) is methyl 1-(2-oxo-1H-pyridine-4-carbonyl)piperidine-4-carboxylate.
What is the SMILES notation for methyl 1-(2-oxo-1H-pyridine-4-carbonyl)piperidine-4-carboxylate?
The canonical SMILES for methyl 1-(2-oxo-1H-pyridine-4-carbonyl)piperidine-4-carboxylate is COC(=O)C1CCN(C(=O)c2cc[nH]c(=O)c2)CC1.
What is the InChIKey of methyl 1-(2-oxo-1H-pyridine-4-carbonyl)piperidine-4-carboxylate?
The InChIKey is FWEBCKVGYCYDAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O4/c1-19-13(18)9-3-6-15(7-4-9)12(17)10-2-5-14-11(16)8-10/h2,5,8-9H,3-4,6-7H2,1H3,(H,14,16).
What are the key properties of methyl 1-(2-oxo-1H-pyridine-4-carbonyl)piperidine-4-carboxylate?
methyl 1-(2-oxo-1H-pyridine-4-carbonyl)piperidine-4-carboxylate has a molecular weight of 264.28 g/mol, XLogP of 0.40, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 1-(2-oxo-1H-pyridine-4-carbonyl)piperidine-4-carboxylate is sourced from PubChem (CID 103762652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).