N-ethyl-1-pyridin-2-yloctan-3-amine

C15H26N2 — CID 105129891

IUPACN-ethyl-1-pyridin-2-yloctan-3-amine
SMILESCCCCCC(CCc1ccccn1)NCC
InChIInChI=1S/C15H26N2/c1-3-5-6-9-14(16-4-2)11-12-15-10-7-8-13-17-15/h7-8,10,13-14,16H,3-6,9,11-12H2,1-2H3
InChIKeyRFMCIJAPCAILJN-UHFFFAOYSA-N
MW234.39 g/mol
LogP3.57
Rot. Bonds9

About N-ethyl-1-pyridin-2-yloctan-3-amine

N-ethyl-1-pyridin-2-yloctan-3-amine (PubChem CID 105129891) has the molecular formula C15H26N2 and a molecular weight of 234.39 g/mol. Its IUPAC name is N-ethyl-1-pyridin-2-yloctan-3-amine.

Molecular Properties

Compound NameN-ethyl-1-pyridin-2-yloctan-3-amine
PubChem CID105129891
Molecular FormulaC15H26N2
Molecular Weight234.39 g/mol
Exact Mass234.21
IUPAC NameN-ethyl-1-pyridin-2-yloctan-3-amine
SMILESCCCCCC(CCc1ccccn1)NCC
InChIInChI=1S/C15H26N2/c1-3-5-6-9-14(16-4-2)11-12-15-10-7-8-13-17-15/h7-8,10,13-14,16H,3-6,9,11-12H2,1-2H3
InChIKeyRFMCIJAPCAILJN-UHFFFAOYSA-N
XLogP3.57
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.39
LogP ≤ 53.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

7-methyl-N-propyl-1-pyridin-2-yloctan-3-amine
CID 105176977
1-(2,6-dimethylphenyl)-N-ethyl-4-pyridin-2-ylbutan-2-amine
CID 105174638
N-ethyl-6-methyl-1-pyridin-2-ylhept-6-en-3-amine
CID 105182655
N-ethyl-1-(5-ethylthiophen-2-yl)-4-pyridin-2-ylbutan-2-amine
CID 105136068
6-methoxy-N-propyl-1-pyridin-2-ylhexan-3-amine
CID 105190112
2-(3-methyloctyl)pyridine;hydrochloride
CID 172780204
1-(2-bromophenyl)-N-ethyl-4-pyridin-2-ylbutan-2-amine
CID 105087681
N-ethyl-4-pyridin-2-yl-1-thiophen-2-ylbutan-2-amine
CID 105134313
N-ethyl-4-methyl-1-pyridin-2-ylpentan-3-amine
CID 105078244
2-undecylpyridine
CID 66882765
1-(3,4-dichlorophenyl)-N-ethyl-4-pyridin-2-ylbutan-2-amine
CID 105136549
N-(pyridin-2-ylmethyl)octan-2-amine
CID 43085262

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-pyridin-2-yloctan-3-amine?
The IUPAC name of N-ethyl-1-pyridin-2-yloctan-3-amine (CID 105129891) is N-ethyl-1-pyridin-2-yloctan-3-amine.
What is the SMILES notation for N-ethyl-1-pyridin-2-yloctan-3-amine?
The canonical SMILES for N-ethyl-1-pyridin-2-yloctan-3-amine is CCCCCC(CCc1ccccn1)NCC.
What is the InChIKey of N-ethyl-1-pyridin-2-yloctan-3-amine?
The InChIKey is RFMCIJAPCAILJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2/c1-3-5-6-9-14(16-4-2)11-12-15-10-7-8-13-17-15/h7-8,10,13-14,16H,3-6,9,11-12H2,1-2H3.
What are the key properties of N-ethyl-1-pyridin-2-yloctan-3-amine?
N-ethyl-1-pyridin-2-yloctan-3-amine has a molecular weight of 234.39 g/mol, XLogP of 3.57, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-pyridin-2-yloctan-3-amine is sourced from PubChem (CID 105129891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).