2-(2-butoxyethoxy)pyridine-3,5-diamine

C11H19N3O2 — CID 19913402

IUPAC2-(2-butoxyethoxy)pyridine-3,5-diamine
SMILESCCCCOCCOc1ncc(N)cc1N
InChIInChI=1S/C11H19N3O2/c1-2-3-4-15-5-6-16-11-10(13)7-9(12)8-14-11/h7-8H,2-6,12-13H2,1H3
InChIKeySZEGFMIHEORPQB-UHFFFAOYSA-N
MW225.29 g/mol
LogP1.44
Rot. Bonds7

About 2-(2-butoxyethoxy)pyridine-3,5-diamine

2-(2-butoxyethoxy)pyridine-3,5-diamine (PubChem CID 19913402) has the molecular formula C11H19N3O2 and a molecular weight of 225.29 g/mol. Its IUPAC name is 2-(2-butoxyethoxy)pyridine-3,5-diamine.

Molecular Properties

Compound Name2-(2-butoxyethoxy)pyridine-3,5-diamine
PubChem CID19913402
Molecular FormulaC11H19N3O2
Molecular Weight225.29 g/mol
Exact Mass225.15
IUPAC Name2-(2-butoxyethoxy)pyridine-3,5-diamine
SMILESCCCCOCCOc1ncc(N)cc1N
InChIInChI=1S/C11H19N3O2/c1-2-3-4-15-5-6-16-11-10(13)7-9(12)8-14-11/h7-8H,2-6,12-13H2,1H3
InChIKeySZEGFMIHEORPQB-UHFFFAOYSA-N
XLogP1.44
TPSA83.39 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.29
LogP ≤ 51.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

6-(2-butoxyethoxy)pyridin-3-amine
CID 3031377
5-bromo-6-heptoxypyridin-3-amine
CID 79535566
5-bromo-6-(2-ethoxyethoxy)pyridin-3-amine
CID 79534577
2-(2-butoxyethoxy)-3-chloro-5-(chloromethyl)pyridine
CID 61267855
5-bromo-2-[3-(2-methoxyethoxy)propoxy]pyridin-3-amine
CID 103400992
2-(2-butoxyethoxy)-6-chloropyridin-3-amine
CID 115474476
2-butoxy-3,5-dichloropyridin-4-amine
CID 21388649
4-(2-pentoxyethoxy)aniline
CID 43274923
5-bromo-4-(2-butoxyethoxy)pyridin-3-amine
CID 103518731
5-amino-6-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]pyridine-3-carbonitrile
CID 103469800
4-(2-heptoxyethoxy)aniline
CID 43366149
5-(2-butoxyethoxy)-3-methylisoquinolin-8-amine
CID 102713811

Frequently Asked Questions

What is the IUPAC name of 2-(2-butoxyethoxy)pyridine-3,5-diamine?
The IUPAC name of 2-(2-butoxyethoxy)pyridine-3,5-diamine (CID 19913402) is 2-(2-butoxyethoxy)pyridine-3,5-diamine.
What is the SMILES notation for 2-(2-butoxyethoxy)pyridine-3,5-diamine?
The canonical SMILES for 2-(2-butoxyethoxy)pyridine-3,5-diamine is CCCCOCCOc1ncc(N)cc1N.
What is the InChIKey of 2-(2-butoxyethoxy)pyridine-3,5-diamine?
The InChIKey is SZEGFMIHEORPQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O2/c1-2-3-4-15-5-6-16-11-10(13)7-9(12)8-14-11/h7-8H,2-6,12-13H2,1H3.
What are the key properties of 2-(2-butoxyethoxy)pyridine-3,5-diamine?
2-(2-butoxyethoxy)pyridine-3,5-diamine has a molecular weight of 225.29 g/mol, XLogP of 1.44, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-butoxyethoxy)pyridine-3,5-diamine is sourced from PubChem (CID 19913402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).