6-oxo-N-[2-oxo-2-(propylamino)ethyl]-1H-pyridine-3-carboxamide

C11H15N3O3 — CID 30536910

IUPAC6-oxo-N-[2-oxo-2-(propylamino)ethyl]-1H-pyridine-3-carboxamide
SMILESCCCNC(=O)CNC(=O)c1ccc(=O)[nH]c1
InChIInChI=1S/C11H15N3O3/c1-2-5-12-10(16)7-14-11(17)8-3-4-9(15)13-6-8/h3-4,6H,2,5,7H2,1H3,(H,12,16)(H,13,15)(H,14,17)
InChIKeyDUDJXNFTTRQERR-UHFFFAOYSA-N
MW237.26 g/mol
LogP-0.37
Rot. Bonds5

About 6-oxo-N-[2-oxo-2-(propylamino)ethyl]-1H-pyridine-3-carboxamide

6-oxo-N-[2-oxo-2-(propylamino)ethyl]-1H-pyridine-3-carboxamide (PubChem CID 30536910) has the molecular formula C11H15N3O3 and a molecular weight of 237.26 g/mol. Its IUPAC name is 6-oxo-N-[2-oxo-2-(propylamino)ethyl]-1H-pyridine-3-carboxamide.

Molecular Properties

Compound Name6-oxo-N-[2-oxo-2-(propylamino)ethyl]-1H-pyridine-3-carboxamide
PubChem CID30536910
Molecular FormulaC11H15N3O3
Molecular Weight237.26 g/mol
Exact Mass237.11
IUPAC Name6-oxo-N-[2-oxo-2-(propylamino)ethyl]-1H-pyridine-3-carboxamide
SMILESCCCNC(=O)CNC(=O)c1ccc(=O)[nH]c1
InChIInChI=1S/C11H15N3O3/c1-2-5-12-10(16)7-14-11(17)8-3-4-9(15)13-6-8/h3-4,6H,2,5,7H2,1H3,(H,12,16)(H,13,15)(H,14,17)
InChIKeyDUDJXNFTTRQERR-UHFFFAOYSA-N
XLogP-0.37
TPSA91.06 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.26
LogP ≤ 5-0.37
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-oxo-N-[2-oxo-2-(propylamino)ethyl]-1H-pyridine-3-carboxamide?
The IUPAC name of 6-oxo-N-[2-oxo-2-(propylamino)ethyl]-1H-pyridine-3-carboxamide (CID 30536910) is 6-oxo-N-[2-oxo-2-(propylamino)ethyl]-1H-pyridine-3-carboxamide.
What is the SMILES notation for 6-oxo-N-[2-oxo-2-(propylamino)ethyl]-1H-pyridine-3-carboxamide?
The canonical SMILES for 6-oxo-N-[2-oxo-2-(propylamino)ethyl]-1H-pyridine-3-carboxamide is CCCNC(=O)CNC(=O)c1ccc(=O)[nH]c1.
What is the InChIKey of 6-oxo-N-[2-oxo-2-(propylamino)ethyl]-1H-pyridine-3-carboxamide?
The InChIKey is DUDJXNFTTRQERR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O3/c1-2-5-12-10(16)7-14-11(17)8-3-4-9(15)13-6-8/h3-4,6H,2,5,7H2,1H3,(H,12,16)(H,13,15)(H,14,17).
What are the key properties of 6-oxo-N-[2-oxo-2-(propylamino)ethyl]-1H-pyridine-3-carboxamide?
6-oxo-N-[2-oxo-2-(propylamino)ethyl]-1H-pyridine-3-carboxamide has a molecular weight of 237.26 g/mol, XLogP of -0.37, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-oxo-N-[2-oxo-2-(propylamino)ethyl]-1H-pyridine-3-carboxamide is sourced from PubChem (CID 30536910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).