N-(1-butyl-5,6-dimethyl-2-oxo-3-pyridinyl)-2-methylbenzamide

C19H24N2O2 — CID 71583421

IUPACN-(1-butyl-5,6-dimethyl-2-oxo-3-pyridinyl)-2-methylbenzamide
SMILESCCCCn1c(C)c(C)cc(NC(=O)c2ccccc2C)c1=O
InChIInChI=1S/C19H24N2O2/c1-5-6-11-21-15(4)14(3)12-17(19(21)23)20-18(22)16-10-8-7-9-13(16)2/h7-10,12H,5-6,11H2,1-4H3,(H,20,22)
InChIKeyIPCYPXCGYWGJEK-UHFFFAOYSA-N
MW312.41 g/mol
LogP3.83
Rot. Bonds5

About N-(1-butyl-5,6-dimethyl-2-oxo-3-pyridinyl)-2-methylbenzamide

N-(1-butyl-5,6-dimethyl-2-oxo-3-pyridinyl)-2-methylbenzamide (PubChem CID 71583421) has the molecular formula C19H24N2O2 and a molecular weight of 312.41 g/mol. Its IUPAC name is N-(1-butyl-5,6-dimethyl-2-oxo-3-pyridinyl)-2-methylbenzamide.

Molecular Properties

Compound NameN-(1-butyl-5,6-dimethyl-2-oxo-3-pyridinyl)-2-methylbenzamide
PubChem CID71583421
Molecular FormulaC19H24N2O2
Molecular Weight312.41 g/mol
Exact Mass312.18
IUPAC NameN-(1-butyl-5,6-dimethyl-2-oxo-3-pyridinyl)-2-methylbenzamide
SMILESCCCCn1c(C)c(C)cc(NC(=O)c2ccccc2C)c1=O
InChIInChI=1S/C19H24N2O2/c1-5-6-11-21-15(4)14(3)12-17(19(21)23)20-18(22)16-10-8-7-9-13(16)2/h7-10,12H,5-6,11H2,1-4H3,(H,20,22)
InChIKeyIPCYPXCGYWGJEK-UHFFFAOYSA-N
XLogP3.83
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.41
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1-butyl-5,6-dimethyl-2-oxo-3-pyridinyl)-2-methylbenzamide?
The IUPAC name of N-(1-butyl-5,6-dimethyl-2-oxo-3-pyridinyl)-2-methylbenzamide (CID 71583421) is N-(1-butyl-5,6-dimethyl-2-oxo-3-pyridinyl)-2-methylbenzamide.
What is the SMILES notation for N-(1-butyl-5,6-dimethyl-2-oxo-3-pyridinyl)-2-methylbenzamide?
The canonical SMILES for N-(1-butyl-5,6-dimethyl-2-oxo-3-pyridinyl)-2-methylbenzamide is CCCCn1c(C)c(C)cc(NC(=O)c2ccccc2C)c1=O.
What is the InChIKey of N-(1-butyl-5,6-dimethyl-2-oxo-3-pyridinyl)-2-methylbenzamide?
The InChIKey is IPCYPXCGYWGJEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O2/c1-5-6-11-21-15(4)14(3)12-17(19(21)23)20-18(22)16-10-8-7-9-13(16)2/h7-10,12H,5-6,11H2,1-4H3,(H,20,22).
What are the key properties of N-(1-butyl-5,6-dimethyl-2-oxo-3-pyridinyl)-2-methylbenzamide?
N-(1-butyl-5,6-dimethyl-2-oxo-3-pyridinyl)-2-methylbenzamide has a molecular weight of 312.41 g/mol, XLogP of 3.83, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-butyl-5,6-dimethyl-2-oxo-3-pyridinyl)-2-methylbenzamide is sourced from PubChem (CID 71583421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).