1-(2,6-dimethyl-3-pyridinyl)-N-ethylbutan-1-amine

C13H22N2 — CID 105080327

IUPAC1-(2,6-dimethyl-3-pyridinyl)-N-ethylbutan-1-amine
SMILESCCCC(NCC)c1ccc(C)nc1C
InChIInChI=1S/C13H22N2/c1-5-7-13(14-6-2)12-9-8-10(3)15-11(12)4/h8-9,13-14H,5-7H2,1-4H3
InChIKeyAWPWDGMYTKZAQS-UHFFFAOYSA-N
MW206.33 g/mol
LogP3.15
Rot. Bonds5

About 1-(2,6-dimethyl-3-pyridinyl)-N-ethylbutan-1-amine

1-(2,6-dimethyl-3-pyridinyl)-N-ethylbutan-1-amine (PubChem CID 105080327) has the molecular formula C13H22N2 and a molecular weight of 206.33 g/mol. Its IUPAC name is 1-(2,6-dimethyl-3-pyridinyl)-N-ethylbutan-1-amine.

Molecular Properties

Compound Name1-(2,6-dimethyl-3-pyridinyl)-N-ethylbutan-1-amine
PubChem CID105080327
Molecular FormulaC13H22N2
Molecular Weight206.33 g/mol
Exact Mass206.18
IUPAC Name1-(2,6-dimethyl-3-pyridinyl)-N-ethylbutan-1-amine
SMILESCCCC(NCC)c1ccc(C)nc1C
InChIInChI=1S/C13H22N2/c1-5-7-13(14-6-2)12-9-8-10(3)15-11(12)4/h8-9,13-14H,5-7H2,1-4H3
InChIKeyAWPWDGMYTKZAQS-UHFFFAOYSA-N
XLogP3.15
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.33
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-(2,6-dimethyl-3-pyridinyl)-N-ethylbutan-1-amine 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

1-(2,6-dimethyl-3-pyridinyl)-N-ethyloctan-1-amine
CID 105124811
1-(2,6-dimethyl-3-pyridinyl)-N-methylbutan-1-amine
CID 105080249
1-(2,6-dimethyl-3-pyridinyl)-N-ethyl-4-phenylbutan-1-amine
CID 105139820
1-(2,6-dimethyl-3-pyridinyl)-N-ethylpent-3-yn-1-amine
CID 105112281
2-(2,6-dimethylphenyl)-1-(2,6-dimethyl-3-pyridinyl)-N-ethylethanamine
CID 105174594
1-(2,6-dimethyl-3-pyridinyl)-3-methyl-N-propylhexan-1-amine
CID 105137878
1-(2,6-dimethyl-3-pyridinyl)-N-methylpentan-1-amine
CID 105125315
1-(2,6-dimethyl-3-pyridinyl)-N-ethyl-2-methylbutan-1-amine
CID 105170505
1-(2,6-dimethyl-3-pyridinyl)-N-methylpropan-1-amine
CID 105078634
1-(2,6-dimethyl-3-pyridinyl)-N-methyloctan-1-amine
CID 105124721
N-[(2,6-dimethyl-3-pyridinyl)-(2-methylphenyl)methyl]ethanamine
CID 105094633
1-(2,6-dimethyl-3-pyridinyl)heptylhydrazine
CID 105293944

Frequently Asked Questions

What is the IUPAC name of 1-(2,6-dimethyl-3-pyridinyl)-N-ethylbutan-1-amine?
The IUPAC name of 1-(2,6-dimethyl-3-pyridinyl)-N-ethylbutan-1-amine (CID 105080327) is 1-(2,6-dimethyl-3-pyridinyl)-N-ethylbutan-1-amine.
What is the SMILES notation for 1-(2,6-dimethyl-3-pyridinyl)-N-ethylbutan-1-amine?
The canonical SMILES for 1-(2,6-dimethyl-3-pyridinyl)-N-ethylbutan-1-amine is CCCC(NCC)c1ccc(C)nc1C.
What is the InChIKey of 1-(2,6-dimethyl-3-pyridinyl)-N-ethylbutan-1-amine?
The InChIKey is AWPWDGMYTKZAQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2/c1-5-7-13(14-6-2)12-9-8-10(3)15-11(12)4/h8-9,13-14H,5-7H2,1-4H3.
What are the key properties of 1-(2,6-dimethyl-3-pyridinyl)-N-ethylbutan-1-amine?
1-(2,6-dimethyl-3-pyridinyl)-N-ethylbutan-1-amine has a molecular weight of 206.33 g/mol, XLogP of 3.15, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,6-dimethyl-3-pyridinyl)-N-ethylbutan-1-amine is sourced from PubChem (CID 105080327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).