3-piperidin-1-yl-2-thiophen-2-ylpropan-1-ol

C12H19NOS — CID 117240379

IUPAC3-piperidin-1-yl-2-thiophen-2-ylpropan-1-ol
SMILESOCC(CN1CCCCC1)c1cccs1
InChIInChI=1S/C12H19NOS/c14-10-11(12-5-4-8-15-12)9-13-6-2-1-3-7-13/h4-5,8,11,14H,1-3,6-7,9-10H2
InChIKeyHYWZNPLIKKVKGD-UHFFFAOYSA-N
MW225.36 g/mol
LogP2.31
Rot. Bonds4

About 3-piperidin-1-yl-2-thiophen-2-ylpropan-1-ol

3-piperidin-1-yl-2-thiophen-2-ylpropan-1-ol (PubChem CID 117240379) has the molecular formula C12H19NOS and a molecular weight of 225.36 g/mol. Its IUPAC name is 3-piperidin-1-yl-2-thiophen-2-ylpropan-1-ol.

Molecular Properties

Compound Name3-piperidin-1-yl-2-thiophen-2-ylpropan-1-ol
PubChem CID117240379
Molecular FormulaC12H19NOS
Molecular Weight225.36 g/mol
Exact Mass225.12
IUPAC Name3-piperidin-1-yl-2-thiophen-2-ylpropan-1-ol
SMILESOCC(CN1CCCCC1)c1cccs1
InChIInChI=1S/C12H19NOS/c14-10-11(12-5-4-8-15-12)9-13-6-2-1-3-7-13/h4-5,8,11,14H,1-3,6-7,9-10H2
InChIKeyHYWZNPLIKKVKGD-UHFFFAOYSA-N
XLogP2.31
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.36
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-morpholin-4-yl-2-thiophen-2-ylpropan-1-ol
CID 117240417
2-pyrrolidin-1-yl-1-thiophen-2-ylethanol
CID 55212055
2-(azocan-1-yl)-1-thiophen-2-ylethanamine
CID 115287666
2-(5-methylthiophen-2-yl)-3-pyrrolidin-1-ylpropan-1-ol
CID 117240368
2-[1-(azepan-1-yl)-3-hydroxypropan-2-yl]phenol
CID 117243887
3-(azepan-1-yl)-2-[4-(trifluoromethyl)phenyl]propan-1-ol
CID 117244790
2-(1-hydroxy-3-pyrrolidin-1-ylpropan-2-yl)phenol
CID 117243867
3-sulfanyl-2-thiophen-2-ylpropan-1-ol
CID 117240751
2-methyl-N-(1-pyrrolidin-1-ylpropan-2-yl)-1-thiophen-2-ylpropan-1-amine
CID 54953108
(2S)-1-(azepan-1-yl)-3-(thiophen-2-ylmethoxy)propan-2-ol
CID 2381133
2-(2-piperidin-1-ylethylamino)-1-thiophen-2-ylethanol
CID 60970344
3-(methylamino)-2-thiophen-2-ylpropan-1-ol
CID 117240343

Frequently Asked Questions

What is the IUPAC name of 3-piperidin-1-yl-2-thiophen-2-ylpropan-1-ol?
The IUPAC name of 3-piperidin-1-yl-2-thiophen-2-ylpropan-1-ol (CID 117240379) is 3-piperidin-1-yl-2-thiophen-2-ylpropan-1-ol.
What is the SMILES notation for 3-piperidin-1-yl-2-thiophen-2-ylpropan-1-ol?
The canonical SMILES for 3-piperidin-1-yl-2-thiophen-2-ylpropan-1-ol is OCC(CN1CCCCC1)c1cccs1.
What is the InChIKey of 3-piperidin-1-yl-2-thiophen-2-ylpropan-1-ol?
The InChIKey is HYWZNPLIKKVKGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NOS/c14-10-11(12-5-4-8-15-12)9-13-6-2-1-3-7-13/h4-5,8,11,14H,1-3,6-7,9-10H2.
What are the key properties of 3-piperidin-1-yl-2-thiophen-2-ylpropan-1-ol?
3-piperidin-1-yl-2-thiophen-2-ylpropan-1-ol has a molecular weight of 225.36 g/mol, XLogP of 2.31, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-piperidin-1-yl-2-thiophen-2-ylpropan-1-ol is sourced from PubChem (CID 117240379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).