(2S)-1-(6-methoxy-3-pyridinyl)pentan-2-amine

C11H18N2O — CID 104932333

IUPAC(2S)-1-(6-methoxy-3-pyridinyl)pentan-2-amine
SMILESCCC[C@H](N)Cc1ccc(OC)nc1
InChIInChI=1S/C11H18N2O/c1-3-4-10(12)7-9-5-6-11(14-2)13-8-9/h5-6,8,10H,3-4,7,12H2,1-2H3/t10-/m0/s1
InChIKeyYILLOQVEWFNFOD-JTQLQIEISA-N
MW194.28 g/mol
LogP1.76
Rot. Bonds5

About (2S)-1-(6-methoxy-3-pyridinyl)pentan-2-amine

(2S)-1-(6-methoxy-3-pyridinyl)pentan-2-amine (PubChem CID 104932333) has the molecular formula C11H18N2O and a molecular weight of 194.28 g/mol. Its IUPAC name is (2S)-1-(6-methoxy-3-pyridinyl)pentan-2-amine.

Molecular Properties

Compound Name(2S)-1-(6-methoxy-3-pyridinyl)pentan-2-amine
PubChem CID104932333
Molecular FormulaC11H18N2O
Molecular Weight194.28 g/mol
Exact Mass194.14
IUPAC Name(2S)-1-(6-methoxy-3-pyridinyl)pentan-2-amine
SMILESCCC[C@H](N)Cc1ccc(OC)nc1
InChIInChI=1S/C11H18N2O/c1-3-4-10(12)7-9-5-6-11(14-2)13-8-9/h5-6,8,10H,3-4,7,12H2,1-2H3/t10-/m0/s1
InChIKeyYILLOQVEWFNFOD-JTQLQIEISA-N
XLogP1.76
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6,6,6-trifluoro-1-(6-methoxy-3-pyridinyl)hexan-2-amine
CID 115517420
1-(2-methylpyrimidin-5-yl)pentan-2-amine
CID 82409313
(1R)-1-[3-[(6-methoxy-3-pyridinyl)methyl]-1,2,4-oxadiazol-5-yl]butan-1-amine
CID 107565463
[1-(6-methoxy-3-pyridinyl)-3-methylbutan-2-yl]hydrazine
CID 105250512
1-(6-methoxy-3-pyridinyl)-3-methylhexan-2-one
CID 107896356
methyl 2-chloro-3-(6-methoxy-3-pyridinyl)propanoate
CID 14444193
[1-(6-methoxy-3-pyridinyl)-6-methylheptan-2-yl]hydrazine
CID 105250649
1-[6-(2,3,6-trimethylphenoxy)-3-pyridinyl]butan-2-amine
CID 80627302
2-(6-methoxy-3-pyridinyl)-1-(1-methylpyrazol-3-yl)ethanamine
CID 103131183
(1R)-1-(6-methoxy-3-pyridinyl)pentan-1-amine
CID 55278684
[1-(6-methoxy-3-pyridinyl)-3-methylbut-3-en-2-yl]hydrazine
CID 105250613
N-[(6-methoxy-3-pyridinyl)methyl]heptan-3-amine
CID 63946078

Frequently Asked Questions

What is the IUPAC name of (2S)-1-(6-methoxy-3-pyridinyl)pentan-2-amine?
The IUPAC name of (2S)-1-(6-methoxy-3-pyridinyl)pentan-2-amine (CID 104932333) is (2S)-1-(6-methoxy-3-pyridinyl)pentan-2-amine.
What is the SMILES notation for (2S)-1-(6-methoxy-3-pyridinyl)pentan-2-amine?
The canonical SMILES for (2S)-1-(6-methoxy-3-pyridinyl)pentan-2-amine is CCC[C@H](N)Cc1ccc(OC)nc1.
What is the InChIKey of (2S)-1-(6-methoxy-3-pyridinyl)pentan-2-amine?
The InChIKey is YILLOQVEWFNFOD-JTQLQIEISA-N. The full InChI is InChI=1S/C11H18N2O/c1-3-4-10(12)7-9-5-6-11(14-2)13-8-9/h5-6,8,10H,3-4,7,12H2,1-2H3/t10-/m0/s1.
What are the key properties of (2S)-1-(6-methoxy-3-pyridinyl)pentan-2-amine?
(2S)-1-(6-methoxy-3-pyridinyl)pentan-2-amine has a molecular weight of 194.28 g/mol, XLogP of 1.76, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-1-(6-methoxy-3-pyridinyl)pentan-2-amine is sourced from PubChem (CID 104932333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).