N-[2-[(2-ethyl-6-methyl-3-pyridinyl)oxy]ethyl]-2-methylbutan-2-amine

C15H26N2O — CID 103175670

IUPACN-[2-[(2-ethyl-6-methyl-3-pyridinyl)oxy]ethyl]-2-methylbutan-2-amine
SMILESCCc1nc(C)ccc1OCCNC(C)(C)CC
InChIInChI=1S/C15H26N2O/c1-6-13-14(9-8-12(3)17-13)18-11-10-16-15(4,5)7-2/h8-9,16H,6-7,10-11H2,1-5H3
InChIKeyTZMUKCOZBPILFU-UHFFFAOYSA-N
MW250.39 g/mol
LogP3.11
Rot. Bonds7

About N-[2-[(2-ethyl-6-methyl-3-pyridinyl)oxy]ethyl]-2-methylbutan-2-amine

N-[2-[(2-ethyl-6-methyl-3-pyridinyl)oxy]ethyl]-2-methylbutan-2-amine (PubChem CID 103175670) has the molecular formula C15H26N2O and a molecular weight of 250.39 g/mol. Its IUPAC name is N-[2-[(2-ethyl-6-methyl-3-pyridinyl)oxy]ethyl]-2-methylbutan-2-amine.

Molecular Properties

Compound NameN-[2-[(2-ethyl-6-methyl-3-pyridinyl)oxy]ethyl]-2-methylbutan-2-amine
PubChem CID103175670
Molecular FormulaC15H26N2O
Molecular Weight250.39 g/mol
Exact Mass250.20
IUPAC NameN-[2-[(2-ethyl-6-methyl-3-pyridinyl)oxy]ethyl]-2-methylbutan-2-amine
SMILESCCc1nc(C)ccc1OCCNC(C)(C)CC
InChIInChI=1S/C15H26N2O/c1-6-13-14(9-8-12(3)17-13)18-11-10-16-15(4,5)7-2/h8-9,16H,6-7,10-11H2,1-5H3
InChIKeyTZMUKCOZBPILFU-UHFFFAOYSA-N
XLogP3.11
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.39
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[2-[(2-ethyl-6-methyl-3-pyridinyl)oxy]ethyl]-2-methylbutan-2-amine?
The IUPAC name of N-[2-[(2-ethyl-6-methyl-3-pyridinyl)oxy]ethyl]-2-methylbutan-2-amine (CID 103175670) is N-[2-[(2-ethyl-6-methyl-3-pyridinyl)oxy]ethyl]-2-methylbutan-2-amine.
What is the SMILES notation for N-[2-[(2-ethyl-6-methyl-3-pyridinyl)oxy]ethyl]-2-methylbutan-2-amine?
The canonical SMILES for N-[2-[(2-ethyl-6-methyl-3-pyridinyl)oxy]ethyl]-2-methylbutan-2-amine is CCc1nc(C)ccc1OCCNC(C)(C)CC.
What is the InChIKey of N-[2-[(2-ethyl-6-methyl-3-pyridinyl)oxy]ethyl]-2-methylbutan-2-amine?
The InChIKey is TZMUKCOZBPILFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O/c1-6-13-14(9-8-12(3)17-13)18-11-10-16-15(4,5)7-2/h8-9,16H,6-7,10-11H2,1-5H3.
What are the key properties of N-[2-[(2-ethyl-6-methyl-3-pyridinyl)oxy]ethyl]-2-methylbutan-2-amine?
N-[2-[(2-ethyl-6-methyl-3-pyridinyl)oxy]ethyl]-2-methylbutan-2-amine has a molecular weight of 250.39 g/mol, XLogP of 3.11, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(2-ethyl-6-methyl-3-pyridinyl)oxy]ethyl]-2-methylbutan-2-amine is sourced from PubChem (CID 103175670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).