2-ethyl-N-(6-methyl-2-pyridinyl)butanamide

C12H18N2O — CID 5060766

IUPAC2-ethyl-N-(6-methyl-2-pyridinyl)butanamide
SMILESCCC(CC)C(=O)Nc1cccc(C)n1
InChIInChI=1S/C12H18N2O/c1-4-10(5-2)12(15)14-11-8-6-7-9(3)13-11/h6-8,10H,4-5H2,1-3H3,(H,13,14,15)
InChIKeyFHHNXNDTIDTPCJ-UHFFFAOYSA-N
MW206.29 g/mol
LogP2.76
Rot. Bonds4

About 2-ethyl-N-(6-methyl-2-pyridinyl)butanamide

2-ethyl-N-(6-methyl-2-pyridinyl)butanamide (PubChem CID 5060766) has the molecular formula C12H18N2O and a molecular weight of 206.29 g/mol. Its IUPAC name is 2-ethyl-N-(6-methyl-2-pyridinyl)butanamide.

Molecular Properties

Compound Name2-ethyl-N-(6-methyl-2-pyridinyl)butanamide
PubChem CID5060766
Molecular FormulaC12H18N2O
Molecular Weight206.29 g/mol
Exact Mass206.14
IUPAC Name2-ethyl-N-(6-methyl-2-pyridinyl)butanamide
SMILESCCC(CC)C(=O)Nc1cccc(C)n1
InChIInChI=1S/C12H18N2O/c1-4-10(5-2)12(15)14-11-8-6-7-9(3)13-11/h6-8,10H,4-5H2,1-3H3,(H,13,14,15)
InChIKeyFHHNXNDTIDTPCJ-UHFFFAOYSA-N
XLogP2.76
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-(6-methyl-2-pyridinyl)butanamide?
The IUPAC name of 2-ethyl-N-(6-methyl-2-pyridinyl)butanamide (CID 5060766) is 2-ethyl-N-(6-methyl-2-pyridinyl)butanamide.
What is the SMILES notation for 2-ethyl-N-(6-methyl-2-pyridinyl)butanamide?
The canonical SMILES for 2-ethyl-N-(6-methyl-2-pyridinyl)butanamide is CCC(CC)C(=O)Nc1cccc(C)n1.
What is the InChIKey of 2-ethyl-N-(6-methyl-2-pyridinyl)butanamide?
The InChIKey is FHHNXNDTIDTPCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O/c1-4-10(5-2)12(15)14-11-8-6-7-9(3)13-11/h6-8,10H,4-5H2,1-3H3,(H,13,14,15).
What are the key properties of 2-ethyl-N-(6-methyl-2-pyridinyl)butanamide?
2-ethyl-N-(6-methyl-2-pyridinyl)butanamide has a molecular weight of 206.29 g/mol, XLogP of 2.76, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-(6-methyl-2-pyridinyl)butanamide is sourced from PubChem (CID 5060766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).