3-(1-amino-2-ethoxybutyl)pyridin-2-amine

C11H19N3O — CID 116716352

IUPAC3-(1-amino-2-ethoxybutyl)pyridin-2-amine
SMILESCCOC(CC)C(N)c1cccnc1N
InChIInChI=1S/C11H19N3O/c1-3-9(15-4-2)10(12)8-6-5-7-14-11(8)13/h5-7,9-10H,3-4,12H2,1-2H3,(H2,13,14)
InChIKeyYTPWZKZHNMAOLD-UHFFFAOYSA-N
MW209.29 g/mol
LogP1.48
Rot. Bonds5

About 3-(1-amino-2-ethoxybutyl)pyridin-2-amine

3-(1-amino-2-ethoxybutyl)pyridin-2-amine (PubChem CID 116716352) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is 3-(1-amino-2-ethoxybutyl)pyridin-2-amine.

Molecular Properties

Compound Name3-(1-amino-2-ethoxybutyl)pyridin-2-amine
PubChem CID116716352
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC Name3-(1-amino-2-ethoxybutyl)pyridin-2-amine
SMILESCCOC(CC)C(N)c1cccnc1N
InChIInChI=1S/C11H19N3O/c1-3-9(15-4-2)10(12)8-6-5-7-14-11(8)13/h5-7,9-10H,3-4,12H2,1-2H3,(H2,13,14)
InChIKeyYTPWZKZHNMAOLD-UHFFFAOYSA-N
XLogP1.48
TPSA74.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 51.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-(1-amino-2-methoxybutyl)pyridin-2-amine
CID 116715178
3-[2-ethoxy-1-(methylamino)butyl]pyridin-2-amine
CID 116716649
2-ethoxy-1-(2-ethoxyphenyl)butan-1-amine
CID 116716256
3-(1-amino-2-cyclohexyl-2-ethoxyethyl)pyridin-2-amine
CID 116772126
3-[(1S)-1-aminopropyl]pyridin-2-amine;hydrochloride
CID 171230912
(1S,2S)-1-(2-amino-3-pyridinyl)propane-1,2-diamine
CID 131122997
3-(1-amino-2,2-dimethoxyethyl)pyridin-2-amine
CID 79492532
(1R)-1-amino-1-(2-amino-3-pyridinyl)propan-2-ol
CID 130961552
(1R,2R)-2-amino-1-(2-amino-3-pyridinyl)butan-1-ol
CID 130848050
1-(2-amino-3-pyridinyl)-2-ethoxy-3,3-dimethylbutan-1-ol
CID 116713305
3-[(3S)-2-methylpentan-3-yl]pyridin-2-amine
CID 176663633
3-ethoxy-1-pyridin-2-ylpentan-2-amine
CID 116716297

Frequently Asked Questions

What is the IUPAC name of 3-(1-amino-2-ethoxybutyl)pyridin-2-amine?
The IUPAC name of 3-(1-amino-2-ethoxybutyl)pyridin-2-amine (CID 116716352) is 3-(1-amino-2-ethoxybutyl)pyridin-2-amine.
What is the SMILES notation for 3-(1-amino-2-ethoxybutyl)pyridin-2-amine?
The canonical SMILES for 3-(1-amino-2-ethoxybutyl)pyridin-2-amine is CCOC(CC)C(N)c1cccnc1N.
What is the InChIKey of 3-(1-amino-2-ethoxybutyl)pyridin-2-amine?
The InChIKey is YTPWZKZHNMAOLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-3-9(15-4-2)10(12)8-6-5-7-14-11(8)13/h5-7,9-10H,3-4,12H2,1-2H3,(H2,13,14).
What are the key properties of 3-(1-amino-2-ethoxybutyl)pyridin-2-amine?
3-(1-amino-2-ethoxybutyl)pyridin-2-amine has a molecular weight of 209.29 g/mol, XLogP of 1.48, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-amino-2-ethoxybutyl)pyridin-2-amine is sourced from PubChem (CID 116716352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).