2-ethyl-2-(hydroxymethyl)-N-(6-methyl-3-pyridinyl)butanamide

C13H20N2O2 — CID 137348231

IUPAC2-ethyl-2-(hydroxymethyl)-N-(6-methyl-3-pyridinyl)butanamide
SMILESCCC(CC)(CO)C(=O)Nc1ccc(C)nc1
InChIInChI=1S/C13H20N2O2/c1-4-13(5-2,9-16)12(17)15-11-7-6-10(3)14-8-11/h6-8,16H,4-5,9H2,1-3H3,(H,15,17)
InChIKeyFUZYSBUZNYZZBN-UHFFFAOYSA-N
MW236.31 g/mol
LogP2.13
Rot. Bonds5

About 2-ethyl-2-(hydroxymethyl)-N-(6-methyl-3-pyridinyl)butanamide

2-ethyl-2-(hydroxymethyl)-N-(6-methyl-3-pyridinyl)butanamide (PubChem CID 137348231) has the molecular formula C13H20N2O2 and a molecular weight of 236.31 g/mol. Its IUPAC name is 2-ethyl-2-(hydroxymethyl)-N-(6-methyl-3-pyridinyl)butanamide.

Molecular Properties

Compound Name2-ethyl-2-(hydroxymethyl)-N-(6-methyl-3-pyridinyl)butanamide
PubChem CID137348231
Molecular FormulaC13H20N2O2
Molecular Weight236.31 g/mol
Exact Mass236.15
IUPAC Name2-ethyl-2-(hydroxymethyl)-N-(6-methyl-3-pyridinyl)butanamide
SMILESCCC(CC)(CO)C(=O)Nc1ccc(C)nc1
InChIInChI=1S/C13H20N2O2/c1-4-13(5-2,9-16)12(17)15-11-7-6-10(3)14-8-11/h6-8,16H,4-5,9H2,1-3H3,(H,15,17)
InChIKeyFUZYSBUZNYZZBN-UHFFFAOYSA-N
XLogP2.13
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.31
LogP ≤ 52.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-ethyl-2-(hydroxymethyl)-N-(6-methyl-3-pyridinyl)butanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2,2-dimethyl-N-(pyridin-3-yl)propanamide
CID 4655044
3,3-Diethyl-1-(6-methylpyridin-3-yl)azetidine-2,4-dione
CID 44626812
2-Methyl-n-(pyridin-3-yl)propanamide
CID 281701
N-(3-hydroxypropyl)-N'-(2-pyridinylmethyl)ethanediamide
CID 2849922
N-(pyridin-3-yl)icosa-5,8,11,14-tetraenamide
CID 44589244
2,2-dimethyl-N-[2-oxo-2-(pyridin-3-ylamino)ethyl]propanamide
CID 36863294
(2R)-2,4-dihydroxy-3,3-dimethyl-N-[3-oxo-3-(pyridin-2-ylmethylamino)propyl]butanamide
CID 90682455
3,3-dimethyl-N-(pyridin-2-ylmethyl)butanamide
CID 669802
N-(2-Methylpyridin-3-yl)acetamide
CID 23070203
N-3-pyridinyl-2,2-bis(trifluoromethyl)butanamide
CID 40458557
2-Propyl-N-(3-pyridyl)valeramide
CID 888080
N-[4-(Hydroxymethyl)pyridin-3-yl]-2,2-dimethylpropanamide
CID 17998783

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-2-(hydroxymethyl)-N-(6-methyl-3-pyridinyl)butanamide?
The IUPAC name of 2-ethyl-2-(hydroxymethyl)-N-(6-methyl-3-pyridinyl)butanamide (CID 137348231) is 2-ethyl-2-(hydroxymethyl)-N-(6-methyl-3-pyridinyl)butanamide.
What is the SMILES notation for 2-ethyl-2-(hydroxymethyl)-N-(6-methyl-3-pyridinyl)butanamide?
The canonical SMILES for 2-ethyl-2-(hydroxymethyl)-N-(6-methyl-3-pyridinyl)butanamide is CCC(CC)(CO)C(=O)Nc1ccc(C)nc1.
What is the InChIKey of 2-ethyl-2-(hydroxymethyl)-N-(6-methyl-3-pyridinyl)butanamide?
The InChIKey is FUZYSBUZNYZZBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2/c1-4-13(5-2,9-16)12(17)15-11-7-6-10(3)14-8-11/h6-8,16H,4-5,9H2,1-3H3,(H,15,17).
What are the key properties of 2-ethyl-2-(hydroxymethyl)-N-(6-methyl-3-pyridinyl)butanamide?
2-ethyl-2-(hydroxymethyl)-N-(6-methyl-3-pyridinyl)butanamide has a molecular weight of 236.31 g/mol, XLogP of 2.13, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-2-(hydroxymethyl)-N-(6-methyl-3-pyridinyl)butanamide is sourced from PubChem (CID 137348231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).