(1R)-1-[5-(2,3-dimethylthiomorpholin-4-yl)-2-pyridinyl]propan-1-amine

C14H23N3S — CID 104874543

IUPAC(1R)-1-[5-(2,3-dimethylthiomorpholin-4-yl)-2-pyridinyl]propan-1-amine
SMILESCC[C@@H](N)c1ccc(N2CCSC(C)C2C)cn1
InChIInChI=1S/C14H23N3S/c1-4-13(15)14-6-5-12(9-16-14)17-7-8-18-11(3)10(17)2/h5-6,9-11,13H,4,7-8,15H2,1-3H3/t10?,11?,13-/m1/s1
InChIKeyAIAREEYTXVRNCG-GCZXYKMCSA-N
MW265.43 g/mol
LogP2.82
Rot. Bonds3

About (1R)-1-[5-(2,3-dimethylthiomorpholin-4-yl)-2-pyridinyl]propan-1-amine

(1R)-1-[5-(2,3-dimethylthiomorpholin-4-yl)-2-pyridinyl]propan-1-amine (PubChem CID 104874543) has the molecular formula C14H23N3S and a molecular weight of 265.43 g/mol. Its IUPAC name is (1R)-1-[5-(2,3-dimethylthiomorpholin-4-yl)-2-pyridinyl]propan-1-amine.

Molecular Properties

Compound Name(1R)-1-[5-(2,3-dimethylthiomorpholin-4-yl)-2-pyridinyl]propan-1-amine
PubChem CID104874543
Molecular FormulaC14H23N3S
Molecular Weight265.43 g/mol
Exact Mass265.16
IUPAC Name(1R)-1-[5-(2,3-dimethylthiomorpholin-4-yl)-2-pyridinyl]propan-1-amine
SMILESCC[C@@H](N)c1ccc(N2CCSC(C)C2C)cn1
InChIInChI=1S/C14H23N3S/c1-4-13(15)14-6-5-12(9-16-14)17-7-8-18-11(3)10(17)2/h5-6,9-11,13H,4,7-8,15H2,1-3H3/t10?,11?,13-/m1/s1
InChIKeyAIAREEYTXVRNCG-GCZXYKMCSA-N
XLogP2.82
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.43
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(1R)-1-[5-(2-methylazepan-1-yl)-2-pyridinyl]propan-1-amine
CID 103937411
(1S)-1-[5-(4-methylpiperidin-1-yl)-2-pyridinyl]propan-1-amine
CID 103936871
(1S)-1-[5-(3,4-dimethylpyrrolidin-1-yl)-2-pyridinyl]propan-1-amine
CID 113355142
1-[5-(3-methylpyrrolidin-1-yl)-2-pyridinyl]propan-1-amine
CID 112584254
(1R)-1-[5-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-yl)-2-pyridinyl]propan-1-amine
CID 103937439
(1S)-1-[5-(2,3,3a,4,5,6,7,7a-octahydroindol-1-yl)-2-pyridinyl]propan-1-amine
CID 103937555
1-[5-[(4aR,8aR)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]-2-pyridinyl]propan-1-amine
CID 102726759
1-[5-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)-2-pyridinyl]propan-1-amine
CID 102883952
1-[6-[(1R)-1-aminopropyl]-3-pyridinyl]piperidin-4-ol
CID 103936925
(1R)-1-[5-(4-ethylpiperazin-1-yl)-2-pyridinyl]propan-1-amine
CID 113355072
1-[1-[6-(1-aminopropyl)-3-pyridinyl]piperidin-4-yl]ethanol
CID 106836278
3-[1-[6-[(1R)-1-aminopropyl]-3-pyridinyl]pyrrolidin-2-yl]propan-1-ol
CID 103937288

Frequently Asked Questions

What is the IUPAC name of (1R)-1-[5-(2,3-dimethylthiomorpholin-4-yl)-2-pyridinyl]propan-1-amine?
The IUPAC name of (1R)-1-[5-(2,3-dimethylthiomorpholin-4-yl)-2-pyridinyl]propan-1-amine (CID 104874543) is (1R)-1-[5-(2,3-dimethylthiomorpholin-4-yl)-2-pyridinyl]propan-1-amine.
What is the SMILES notation for (1R)-1-[5-(2,3-dimethylthiomorpholin-4-yl)-2-pyridinyl]propan-1-amine?
The canonical SMILES for (1R)-1-[5-(2,3-dimethylthiomorpholin-4-yl)-2-pyridinyl]propan-1-amine is CC[C@@H](N)c1ccc(N2CCSC(C)C2C)cn1.
What is the InChIKey of (1R)-1-[5-(2,3-dimethylthiomorpholin-4-yl)-2-pyridinyl]propan-1-amine?
The InChIKey is AIAREEYTXVRNCG-GCZXYKMCSA-N. The full InChI is InChI=1S/C14H23N3S/c1-4-13(15)14-6-5-12(9-16-14)17-7-8-18-11(3)10(17)2/h5-6,9-11,13H,4,7-8,15H2,1-3H3/t10?,11?,13-/m1/s1.
What are the key properties of (1R)-1-[5-(2,3-dimethylthiomorpholin-4-yl)-2-pyridinyl]propan-1-amine?
(1R)-1-[5-(2,3-dimethylthiomorpholin-4-yl)-2-pyridinyl]propan-1-amine has a molecular weight of 265.43 g/mol, XLogP of 2.82, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[5-(2,3-dimethylthiomorpholin-4-yl)-2-pyridinyl]propan-1-amine is sourced from PubChem (CID 104874543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).