1-cyclopentyl-3-(2,6-dimethylthiomorpholin-4-yl)propan-2-ol

C14H27NOS — CID 103160060

IUPAC1-cyclopentyl-3-(2,6-dimethylthiomorpholin-4-yl)propan-2-ol
SMILESCC1CN(CC(O)CC2CCCC2)CC(C)S1
InChIInChI=1S/C14H27NOS/c1-11-8-15(9-12(2)17-11)10-14(16)7-13-5-3-4-6-13/h11-14,16H,3-10H2,1-2H3
InChIKeyFUWYYENEKVIZPI-UHFFFAOYSA-N
MW257.44 g/mol
LogP2.75
Rot. Bonds4

About 1-cyclopentyl-3-(2,6-dimethylthiomorpholin-4-yl)propan-2-ol

1-cyclopentyl-3-(2,6-dimethylthiomorpholin-4-yl)propan-2-ol (PubChem CID 103160060) has the molecular formula C14H27NOS and a molecular weight of 257.44 g/mol. Its IUPAC name is 1-cyclopentyl-3-(2,6-dimethylthiomorpholin-4-yl)propan-2-ol.

Molecular Properties

Compound Name1-cyclopentyl-3-(2,6-dimethylthiomorpholin-4-yl)propan-2-ol
PubChem CID103160060
Molecular FormulaC14H27NOS
Molecular Weight257.44 g/mol
Exact Mass257.18
IUPAC Name1-cyclopentyl-3-(2,6-dimethylthiomorpholin-4-yl)propan-2-ol
SMILESCC1CN(CC(O)CC2CCCC2)CC(C)S1
InChIInChI=1S/C14H27NOS/c1-11-8-15(9-12(2)17-11)10-14(16)7-13-5-3-4-6-13/h11-14,16H,3-10H2,1-2H3
InChIKeyFUWYYENEKVIZPI-UHFFFAOYSA-N
XLogP2.75
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.44
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2,6-dimethylthiomorpholin-4-yl)-3-(4-methylpiperidin-1-yl)propan-2-ol
CID 111477005
1-cyclopentyl-3-(3-propan-2-ylpyrrolidin-1-yl)propan-2-ol
CID 103160187
(3R)-1-(3-cyclopentyl-2-hydroxypropyl)pyrrolidin-3-ol
CID 103160997
(3S)-1-(3-cyclopentyl-2-hydroxypropyl)pyrrolidin-3-ol
CID 103160998
1-cyclopentyl-3-[3-(methoxymethyl)piperidin-1-yl]propan-2-ol
CID 103274721
1-(3-cyclopentyl-2-hydroxypropyl)-3-ethylpiperidin-4-ol
CID 103161296
N-[1-(3-cyclopentyl-2-hydroxypropyl)piperidin-4-yl]acetamide
CID 103160182
1-cyclopentyl-3-(2,4-dimethylpiperazin-1-yl)propan-2-ol
CID 103259322
1-cyclopentyl-3-[4-(methoxymethyl)piperidin-1-yl]propan-2-ol
CID 103160053
N-[1-(3-cyclopentyl-2-hydroxypropyl)pyrrolidin-3-yl]acetamide
CID 103160184
1-cyclopentyl-3-(1-methyl-2,3,4,4a,5,7,8,8a-octahydro-1,6-naphthyridin-6-yl)propan-2-ol
CID 103160150
1-cyclopentyl-3-[4-(ethylaminomethyl)piperidin-1-yl]propan-2-ol
CID 103160901

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-3-(2,6-dimethylthiomorpholin-4-yl)propan-2-ol?
The IUPAC name of 1-cyclopentyl-3-(2,6-dimethylthiomorpholin-4-yl)propan-2-ol (CID 103160060) is 1-cyclopentyl-3-(2,6-dimethylthiomorpholin-4-yl)propan-2-ol.
What is the SMILES notation for 1-cyclopentyl-3-(2,6-dimethylthiomorpholin-4-yl)propan-2-ol?
The canonical SMILES for 1-cyclopentyl-3-(2,6-dimethylthiomorpholin-4-yl)propan-2-ol is CC1CN(CC(O)CC2CCCC2)CC(C)S1.
What is the InChIKey of 1-cyclopentyl-3-(2,6-dimethylthiomorpholin-4-yl)propan-2-ol?
The InChIKey is FUWYYENEKVIZPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NOS/c1-11-8-15(9-12(2)17-11)10-14(16)7-13-5-3-4-6-13/h11-14,16H,3-10H2,1-2H3.
What are the key properties of 1-cyclopentyl-3-(2,6-dimethylthiomorpholin-4-yl)propan-2-ol?
1-cyclopentyl-3-(2,6-dimethylthiomorpholin-4-yl)propan-2-ol has a molecular weight of 257.44 g/mol, XLogP of 2.75, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-3-(2,6-dimethylthiomorpholin-4-yl)propan-2-ol is sourced from PubChem (CID 103160060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).