3-ethoxy-N-ethyl-1-pyridin-3-ylhexan-2-amine

C15H26N2O — CID 116718024

IUPAC3-ethoxy-N-ethyl-1-pyridin-3-ylhexan-2-amine
SMILESCCCC(OCC)C(Cc1cccnc1)NCC
InChIInChI=1S/C15H26N2O/c1-4-8-15(18-6-3)14(17-5-2)11-13-9-7-10-16-12-13/h7,9-10,12,14-15,17H,4-6,8,11H2,1-3H3
InChIKeyILVYZUSVTUDYBT-UHFFFAOYSA-N
MW250.39 g/mol
LogP2.81
Rot. Bonds9

About 3-ethoxy-N-ethyl-1-pyridin-3-ylhexan-2-amine

3-ethoxy-N-ethyl-1-pyridin-3-ylhexan-2-amine (PubChem CID 116718024) has the molecular formula C15H26N2O and a molecular weight of 250.39 g/mol. Its IUPAC name is 3-ethoxy-N-ethyl-1-pyridin-3-ylhexan-2-amine.

Molecular Properties

Compound Name3-ethoxy-N-ethyl-1-pyridin-3-ylhexan-2-amine
PubChem CID116718024
Molecular FormulaC15H26N2O
Molecular Weight250.39 g/mol
Exact Mass250.20
IUPAC Name3-ethoxy-N-ethyl-1-pyridin-3-ylhexan-2-amine
SMILESCCCC(OCC)C(Cc1cccnc1)NCC
InChIInChI=1S/C15H26N2O/c1-4-8-15(18-6-3)14(17-5-2)11-13-9-7-10-16-12-13/h7,9-10,12,14-15,17H,4-6,8,11H2,1-3H3
InChIKeyILVYZUSVTUDYBT-UHFFFAOYSA-N
XLogP2.81
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.39
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-ethoxy-N-ethyl-1-pyridin-3-ylhexan-2-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

3-ethoxy-N-ethyl-1-(3-methylphenyl)hexan-2-amine
CID 116718126
1-(3-chlorophenyl)-3-ethoxy-N-ethylhexan-2-amine
CID 116718090
3-ethoxy-N-ethyl-1-(1,3-thiazol-2-yl)hexan-2-amine
CID 116717963
2-ethoxy-1-pyridin-3-ylpentan-1-amine
CID 116717421
1-pyridin-3-ylpentan-2-ol
CID 62553061
1-(2-chloro-4-methylphenyl)-3-ethoxy-N-ethylhexan-2-amine
CID 106868795
N-(pyridin-3-ylmethyl)heptan-4-amine
CID 28671703
N-ethyl-1,1,1-trifluoro-3-pyridin-3-ylpropan-2-amine
CID 66468597
(3-methoxy-1-pyridin-3-ylpentan-2-yl)hydrazine
CID 105270707
methyl 2-(pyridin-3-ylmethyl)pentanoate
CID 174237588
4-ethoxy-1-pyridin-3-ylbutan-2-amine
CID 112688280
N-ethyl-1-propylsulfanyl-3-pyridin-3-ylpropan-2-amine
CID 104736344

Frequently Asked Questions

What is the IUPAC name of 3-ethoxy-N-ethyl-1-pyridin-3-ylhexan-2-amine?
The IUPAC name of 3-ethoxy-N-ethyl-1-pyridin-3-ylhexan-2-amine (CID 116718024) is 3-ethoxy-N-ethyl-1-pyridin-3-ylhexan-2-amine.
What is the SMILES notation for 3-ethoxy-N-ethyl-1-pyridin-3-ylhexan-2-amine?
The canonical SMILES for 3-ethoxy-N-ethyl-1-pyridin-3-ylhexan-2-amine is CCCC(OCC)C(Cc1cccnc1)NCC.
What is the InChIKey of 3-ethoxy-N-ethyl-1-pyridin-3-ylhexan-2-amine?
The InChIKey is ILVYZUSVTUDYBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O/c1-4-8-15(18-6-3)14(17-5-2)11-13-9-7-10-16-12-13/h7,9-10,12,14-15,17H,4-6,8,11H2,1-3H3.
What are the key properties of 3-ethoxy-N-ethyl-1-pyridin-3-ylhexan-2-amine?
3-ethoxy-N-ethyl-1-pyridin-3-ylhexan-2-amine has a molecular weight of 250.39 g/mol, XLogP of 2.81, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethoxy-N-ethyl-1-pyridin-3-ylhexan-2-amine is sourced from PubChem (CID 116718024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).