2-ethyl-N-(4-methyl-2-pyridinyl)hexanamide

C14H22N2O — CID 4195795

IUPAC2-ethyl-N-(4-methyl-2-pyridinyl)hexanamide
SMILESCCCCC(CC)C(=O)NC1=NC=CC(=C1)C
InChIInChI=1S/C14H22N2O/c1-4-6-7-12(5-2)14(17)16-13-10-11(3)8-9-15-13/h8-10,12H,4-7H2,1-3H3,(H,15,16,17)
InChIKeyKUQGACBGARPCDM-UHFFFAOYSA-N
MW234.34 g/mol
LogP3.60
Rot. Bonds6

About 2-ethyl-N-(4-methyl-2-pyridinyl)hexanamide

2-ethyl-N-(4-methyl-2-pyridinyl)hexanamide (PubChem CID 4195795) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is 2-ethyl-N-(4-methyl-2-pyridinyl)hexanamide.

Molecular Properties

Compound Name2-ethyl-N-(4-methyl-2-pyridinyl)hexanamide
PubChem CID4195795
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC Name2-ethyl-N-(4-methyl-2-pyridinyl)hexanamide
SMILESCCCCC(CC)C(=O)NC1=NC=CC(=C1)C
InChIInChI=1S/C14H22N2O/c1-4-6-7-12(5-2)14(17)16-13-10-11(3)8-9-15-13/h8-10,12H,4-7H2,1-3H3,(H,15,16,17)
InChIKeyKUQGACBGARPCDM-UHFFFAOYSA-N
XLogP3.60
TPSA42.00 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity230

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-(4-methyl-2-pyridinyl)hexanamide?
The IUPAC name of 2-ethyl-N-(4-methyl-2-pyridinyl)hexanamide (CID 4195795) is 2-ethyl-N-(4-methyl-2-pyridinyl)hexanamide.
What is the SMILES notation for 2-ethyl-N-(4-methyl-2-pyridinyl)hexanamide?
The canonical SMILES for 2-ethyl-N-(4-methyl-2-pyridinyl)hexanamide is CCCCC(CC)C(=O)NC1=NC=CC(=C1)C.
What is the InChIKey of 2-ethyl-N-(4-methyl-2-pyridinyl)hexanamide?
The InChIKey is KUQGACBGARPCDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O/c1-4-6-7-12(5-2)14(17)16-13-10-11(3)8-9-15-13/h8-10,12H,4-7H2,1-3H3,(H,15,16,17).
What are the key properties of 2-ethyl-N-(4-methyl-2-pyridinyl)hexanamide?
2-ethyl-N-(4-methyl-2-pyridinyl)hexanamide has a molecular weight of 234.34 g/mol, XLogP of 3.60, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-(4-methyl-2-pyridinyl)hexanamide is sourced from PubChem (CID 4195795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).