1-[2-(5-amino-2-oxo-1-pyridinyl)acetyl]-N-methylpiperidine-4-carboxamide

C14H20N4O3 — CID 62816864

IUPAC1-[2-(5-amino-2-oxo-1-pyridinyl)acetyl]-N-methylpiperidine-4-carboxamide
SMILESCNC(=O)C1CCN(C(=O)Cn2cc(N)ccc2=O)CC1
InChIInChI=1S/C14H20N4O3/c1-16-14(21)10-4-6-17(7-5-10)13(20)9-18-8-11(15)2-3-12(18)19/h2-3,8,10H,4-7,9,15H2,1H3,(H,16,21)
InChIKeyXLVVAUQHUWHZBF-UHFFFAOYSA-N
MW292.34 g/mol
LogP-0.58
Rot. Bonds3

About 1-[2-(5-amino-2-oxo-1-pyridinyl)acetyl]-N-methylpiperidine-4-carboxamide

1-[2-(5-amino-2-oxo-1-pyridinyl)acetyl]-N-methylpiperidine-4-carboxamide (PubChem CID 62816864) has the molecular formula C14H20N4O3 and a molecular weight of 292.34 g/mol. Its IUPAC name is 1-[2-(5-amino-2-oxo-1-pyridinyl)acetyl]-N-methylpiperidine-4-carboxamide.

Molecular Properties

Compound Name1-[2-(5-amino-2-oxo-1-pyridinyl)acetyl]-N-methylpiperidine-4-carboxamide
PubChem CID62816864
Molecular FormulaC14H20N4O3
Molecular Weight292.34 g/mol
Exact Mass292.15
IUPAC Name1-[2-(5-amino-2-oxo-1-pyridinyl)acetyl]-N-methylpiperidine-4-carboxamide
SMILESCNC(=O)C1CCN(C(=O)Cn2cc(N)ccc2=O)CC1
InChIInChI=1S/C14H20N4O3/c1-16-14(21)10-4-6-17(7-5-10)13(20)9-18-8-11(15)2-3-12(18)19/h2-3,8,10H,4-7,9,15H2,1H3,(H,16,21)
InChIKeyXLVVAUQHUWHZBF-UHFFFAOYSA-N
XLogP-0.58
TPSA97.43 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.34
LogP ≤ 5-0.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-[2-(5-amino-2-oxo-1-pyridinyl)acetyl]-N-methylpiperidine-4-carboxamide?
The IUPAC name of 1-[2-(5-amino-2-oxo-1-pyridinyl)acetyl]-N-methylpiperidine-4-carboxamide (CID 62816864) is 1-[2-(5-amino-2-oxo-1-pyridinyl)acetyl]-N-methylpiperidine-4-carboxamide.
What is the SMILES notation for 1-[2-(5-amino-2-oxo-1-pyridinyl)acetyl]-N-methylpiperidine-4-carboxamide?
The canonical SMILES for 1-[2-(5-amino-2-oxo-1-pyridinyl)acetyl]-N-methylpiperidine-4-carboxamide is CNC(=O)C1CCN(C(=O)Cn2cc(N)ccc2=O)CC1.
What is the InChIKey of 1-[2-(5-amino-2-oxo-1-pyridinyl)acetyl]-N-methylpiperidine-4-carboxamide?
The InChIKey is XLVVAUQHUWHZBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O3/c1-16-14(21)10-4-6-17(7-5-10)13(20)9-18-8-11(15)2-3-12(18)19/h2-3,8,10H,4-7,9,15H2,1H3,(H,16,21).
What are the key properties of 1-[2-(5-amino-2-oxo-1-pyridinyl)acetyl]-N-methylpiperidine-4-carboxamide?
1-[2-(5-amino-2-oxo-1-pyridinyl)acetyl]-N-methylpiperidine-4-carboxamide has a molecular weight of 292.34 g/mol, XLogP of -0.58, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(5-amino-2-oxo-1-pyridinyl)acetyl]-N-methylpiperidine-4-carboxamide is sourced from PubChem (CID 62816864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).