2-ethyl-N-[(1R)-1-pyridin-2-ylethyl]hexan-1-amine

C15H26N2 — CID 81407759

IUPAC2-ethyl-N-[(1R)-1-pyridin-2-ylethyl]hexan-1-amine
SMILESCCCCC(CC)CN[C@H](C)c1ccccn1
InChIInChI=1S/C15H26N2/c1-4-6-9-14(5-2)12-17-13(3)15-10-7-8-11-16-15/h7-8,10-11,13-14,17H,4-6,9,12H2,1-3H3/t13-,14?/m1/s1
InChIKeyZWSGFIOSRVKYKF-KWCCSABGSA-N
MW234.39 g/mol
LogP3.95
Rot. Bonds8

About 2-ethyl-N-[(1R)-1-pyridin-2-ylethyl]hexan-1-amine

2-ethyl-N-[(1R)-1-pyridin-2-ylethyl]hexan-1-amine (PubChem CID 81407759) has the molecular formula C15H26N2 and a molecular weight of 234.39 g/mol. Its IUPAC name is 2-ethyl-N-[(1R)-1-pyridin-2-ylethyl]hexan-1-amine.

Molecular Properties

Compound Name2-ethyl-N-[(1R)-1-pyridin-2-ylethyl]hexan-1-amine
PubChem CID81407759
Molecular FormulaC15H26N2
Molecular Weight234.39 g/mol
Exact Mass234.21
IUPAC Name2-ethyl-N-[(1R)-1-pyridin-2-ylethyl]hexan-1-amine
SMILESCCCCC(CC)CN[C@H](C)c1ccccn1
InChIInChI=1S/C15H26N2/c1-4-6-9-14(5-2)12-17-13(3)15-10-7-8-11-16-15/h7-8,10-11,13-14,17H,4-6,9,12H2,1-3H3/t13-,14?/m1/s1
InChIKeyZWSGFIOSRVKYKF-KWCCSABGSA-N
XLogP3.95
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.39
LogP ≤ 53.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-ethyl-N-[(1R)-1-pyridin-2-ylethyl]butan-1-amine
CID 28647872
1-[[(1S)-1-pyridin-2-ylethyl]amino]butan-2-ol
CID 81401299
2-ethyl-N-[(1R)-1-(2-methylphenyl)ethyl]hexan-1-amine
CID 81374760
1-(1-pyridin-2-ylethylamino)propan-2-ol
CID 43499405
(2S)-2-ethyl-N-(pyridin-2-ylmethyl)hexan-1-amine
CID 7036530
2-methyl-3-methylsulfanyl-N-(1-pyridin-2-ylethyl)propan-1-amine
CID 63982135
N-[1-(1,3-benzothiazol-2-yl)ethyl]-2-ethylhexan-1-amine
CID 43078478
3-(1-pyridin-2-ylethylamino)propan-1-ol
CID 2772086
N-[(1R)-1-pyridin-2-ylethyl]pentan-2-amine
CID 81401489
2-ethyl-N-(2-methyl-1-phenylpropyl)hexan-1-amine
CID 43767516
1-phenyl-2-(1-pyridin-2-ylethylamino)ethanol
CID 43394637
1-phenyl-2-[[(1R)-1-pyridin-2-ylethyl]amino]ethanol
CID 81407252

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-[(1R)-1-pyridin-2-ylethyl]hexan-1-amine?
The IUPAC name of 2-ethyl-N-[(1R)-1-pyridin-2-ylethyl]hexan-1-amine (CID 81407759) is 2-ethyl-N-[(1R)-1-pyridin-2-ylethyl]hexan-1-amine.
What is the SMILES notation for 2-ethyl-N-[(1R)-1-pyridin-2-ylethyl]hexan-1-amine?
The canonical SMILES for 2-ethyl-N-[(1R)-1-pyridin-2-ylethyl]hexan-1-amine is CCCCC(CC)CN[C@H](C)c1ccccn1.
What is the InChIKey of 2-ethyl-N-[(1R)-1-pyridin-2-ylethyl]hexan-1-amine?
The InChIKey is ZWSGFIOSRVKYKF-KWCCSABGSA-N. The full InChI is InChI=1S/C15H26N2/c1-4-6-9-14(5-2)12-17-13(3)15-10-7-8-11-16-15/h7-8,10-11,13-14,17H,4-6,9,12H2,1-3H3/t13-,14?/m1/s1.
What are the key properties of 2-ethyl-N-[(1R)-1-pyridin-2-ylethyl]hexan-1-amine?
2-ethyl-N-[(1R)-1-pyridin-2-ylethyl]hexan-1-amine has a molecular weight of 234.39 g/mol, XLogP of 3.95, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-[(1R)-1-pyridin-2-ylethyl]hexan-1-amine is sourced from PubChem (CID 81407759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).