N-(6-butyl-2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)acetamide

C16H19N3O2 — CID 20514941

IUPACN-(6-butyl-2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)acetamide
SMILESCCCCc1[nH]c(=O)c(NC(C)=O)cc1-c1ccncc1
InChIInChI=1S/C16H19N3O2/c1-3-4-5-14-13(12-6-8-17-9-7-12)10-15(16(21)19-14)18-11(2)20/h6-10H,3-5H2,1-2H3,(H,18,20)(H,19,21)
InChIKeyKADFQHNNYPLFJB-UHFFFAOYSA-N
MW285.35 g/mol
LogP2.74
Rot. Bonds5

About N-(6-butyl-2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)acetamide

N-(6-butyl-2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)acetamide (PubChem CID 20514941) has the molecular formula C16H19N3O2 and a molecular weight of 285.35 g/mol. Its IUPAC name is N-(6-butyl-2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)acetamide.

Molecular Properties

Compound NameN-(6-butyl-2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)acetamide
PubChem CID20514941
Molecular FormulaC16H19N3O2
Molecular Weight285.35 g/mol
Exact Mass285.15
IUPAC NameN-(6-butyl-2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)acetamide
SMILESCCCCc1[nH]c(=O)c(NC(C)=O)cc1-c1ccncc1
InChIInChI=1S/C16H19N3O2/c1-3-4-5-14-13(12-6-8-17-9-7-12)10-15(16(21)19-14)18-11(2)20/h6-10H,3-5H2,1-2H3,(H,18,20)(H,19,21)
InChIKeyKADFQHNNYPLFJB-UHFFFAOYSA-N
XLogP2.74
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 52.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(6-butyl-2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)acetamide?
The IUPAC name of N-(6-butyl-2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)acetamide (CID 20514941) is N-(6-butyl-2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)acetamide.
What is the SMILES notation for N-(6-butyl-2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)acetamide?
The canonical SMILES for N-(6-butyl-2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)acetamide is CCCCc1[nH]c(=O)c(NC(C)=O)cc1-c1ccncc1.
What is the InChIKey of N-(6-butyl-2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)acetamide?
The InChIKey is KADFQHNNYPLFJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O2/c1-3-4-5-14-13(12-6-8-17-9-7-12)10-15(16(21)19-14)18-11(2)20/h6-10H,3-5H2,1-2H3,(H,18,20)(H,19,21).
What are the key properties of N-(6-butyl-2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)acetamide?
N-(6-butyl-2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)acetamide has a molecular weight of 285.35 g/mol, XLogP of 2.74, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-butyl-2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)acetamide is sourced from PubChem (CID 20514941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).