5-methoxy-4-oxo-N-(2-piperidin-1-ylethyl)-1H-pyridine-2-carboxamide

C14H21N3O3 — CID 74234794

IUPAC5-methoxy-4-oxo-N-(2-piperidin-1-ylethyl)-1H-pyridine-2-carboxamide
SMILESCOc1c[nH]c(C(=O)NCCN2CCCCC2)cc1=O
InChIInChI=1S/C14H21N3O3/c1-20-13-10-16-11(9-12(13)18)14(19)15-5-8-17-6-3-2-4-7-17/h9-10H,2-8H2,1H3,(H,15,19)(H,16,18)
InChIKeyYQWJLVMQTFUBLL-UHFFFAOYSA-N
MW279.34 g/mol
LogP0.60
Rot. Bonds5

About 5-methoxy-4-oxo-N-(2-piperidin-1-ylethyl)-1H-pyridine-2-carboxamide

5-methoxy-4-oxo-N-(2-piperidin-1-ylethyl)-1H-pyridine-2-carboxamide (PubChem CID 74234794) has the molecular formula C14H21N3O3 and a molecular weight of 279.34 g/mol. Its IUPAC name is 5-methoxy-4-oxo-N-(2-piperidin-1-ylethyl)-1H-pyridine-2-carboxamide.

Molecular Properties

Compound Name5-methoxy-4-oxo-N-(2-piperidin-1-ylethyl)-1H-pyridine-2-carboxamide
PubChem CID74234794
Molecular FormulaC14H21N3O3
Molecular Weight279.34 g/mol
Exact Mass279.16
IUPAC Name5-methoxy-4-oxo-N-(2-piperidin-1-ylethyl)-1H-pyridine-2-carboxamide
SMILESCOc1c[nH]c(C(=O)NCCN2CCCCC2)cc1=O
InChIInChI=1S/C14H21N3O3/c1-20-13-10-16-11(9-12(13)18)14(19)15-5-8-17-6-3-2-4-7-17/h9-10H,2-8H2,1H3,(H,15,19)(H,16,18)
InChIKeyYQWJLVMQTFUBLL-UHFFFAOYSA-N
XLogP0.60
TPSA74.43 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.34
LogP ≤ 50.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-methoxy-4-oxo-N-(2-piperidin-1-ylethyl)-1H-pyridine-2-carboxamide?
The IUPAC name of 5-methoxy-4-oxo-N-(2-piperidin-1-ylethyl)-1H-pyridine-2-carboxamide (CID 74234794) is 5-methoxy-4-oxo-N-(2-piperidin-1-ylethyl)-1H-pyridine-2-carboxamide.
What is the SMILES notation for 5-methoxy-4-oxo-N-(2-piperidin-1-ylethyl)-1H-pyridine-2-carboxamide?
The canonical SMILES for 5-methoxy-4-oxo-N-(2-piperidin-1-ylethyl)-1H-pyridine-2-carboxamide is COc1c[nH]c(C(=O)NCCN2CCCCC2)cc1=O.
What is the InChIKey of 5-methoxy-4-oxo-N-(2-piperidin-1-ylethyl)-1H-pyridine-2-carboxamide?
The InChIKey is YQWJLVMQTFUBLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O3/c1-20-13-10-16-11(9-12(13)18)14(19)15-5-8-17-6-3-2-4-7-17/h9-10H,2-8H2,1H3,(H,15,19)(H,16,18).
What are the key properties of 5-methoxy-4-oxo-N-(2-piperidin-1-ylethyl)-1H-pyridine-2-carboxamide?
5-methoxy-4-oxo-N-(2-piperidin-1-ylethyl)-1H-pyridine-2-carboxamide has a molecular weight of 279.34 g/mol, XLogP of 0.60, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-4-oxo-N-(2-piperidin-1-ylethyl)-1H-pyridine-2-carboxamide is sourced from PubChem (CID 74234794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).