1-[(5-methyl-2-thiophen-3-yl-1,3-oxazol-4-yl)methyl]piperidin-4-ol

C14H18N2O2S — CID 110923157

IUPAC1-[(5-methyl-2-thiophen-3-yl-1,3-oxazol-4-yl)methyl]piperidin-4-ol
SMILESCc1oc(-c2ccsc2)nc1CN1CCC(O)CC1
InChIInChI=1S/C14H18N2O2S/c1-10-13(8-16-5-2-12(17)3-6-16)15-14(18-10)11-4-7-19-9-11/h4,7,9,12,17H,2-3,5-6,8H2,1H3
InChIKeyUKWIVIVYNWAMQA-UHFFFAOYSA-N
MW278.38 g/mol
LogP2.67
Rot. Bonds3

About 1-[(5-methyl-2-thiophen-3-yl-1,3-oxazol-4-yl)methyl]piperidin-4-ol

1-[(5-methyl-2-thiophen-3-yl-1,3-oxazol-4-yl)methyl]piperidin-4-ol (PubChem CID 110923157) has the molecular formula C14H18N2O2S and a molecular weight of 278.38 g/mol. Its IUPAC name is 1-[(5-methyl-2-thiophen-3-yl-1,3-oxazol-4-yl)methyl]piperidin-4-ol.

Molecular Properties

Compound Name1-[(5-methyl-2-thiophen-3-yl-1,3-oxazol-4-yl)methyl]piperidin-4-ol
PubChem CID110923157
Molecular FormulaC14H18N2O2S
Molecular Weight278.38 g/mol
Exact Mass278.11
IUPAC Name1-[(5-methyl-2-thiophen-3-yl-1,3-oxazol-4-yl)methyl]piperidin-4-ol
SMILESCc1oc(-c2ccsc2)nc1CN1CCC(O)CC1
InChIInChI=1S/C14H18N2O2S/c1-10-13(8-16-5-2-12(17)3-6-16)15-14(18-10)11-4-7-19-9-11/h4,7,9,12,17H,2-3,5-6,8H2,1H3
InChIKeyUKWIVIVYNWAMQA-UHFFFAOYSA-N
XLogP2.67
TPSA49.50 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.38
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-[1-[(5-methyl-2-thiophen-3-yl-1,3-oxazol-4-yl)methyl]piperidin-2-yl]ethanol
CID 45200824
4-(6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazin-7-ylmethyl)-5-methyl-2-thiophen-3-yl-1,3-oxazole
CID 86796826
5-methyl-2-thiophen-3-yl-4-(triazol-1-ylmethyl)-1,3-oxazole
CID 86816468
(2R)-4-[(5-methyl-2-thiophen-3-yl-1,3-oxazol-4-yl)methyl]-2-(pyrazol-1-ylmethyl)morpholine
CID 95279165
5-methyl-2-thiophen-3-yl-4-[[(3R)-3-(1,2,4-triazol-1-ylmethyl)piperidin-1-yl]methyl]-1,3-oxazole
CID 95341635
1-[2-(5-methyl-2-thiophen-3-yl-1,3-oxazol-4-yl)acetyl]piperidine-4-carboxylic acid
CID 119166403
5-methyl-4-[[3-[(3-methylphenoxy)methyl]piperidin-1-yl]methyl]-2-thiophen-3-yl-1,3-oxazole
CID 45202868
(2S)-4-[(5-methyl-2-thiophen-3-yl-1,3-oxazol-4-yl)methyl]-2-(1,2,4-triazol-1-ylmethyl)morpholine
CID 95345825
1-[(3-methylphenyl)methyl]-4-[(5-methyl-2-thiophen-3-yl-1,3-oxazol-4-yl)methyl]piperazin-2-one
CID 25458230
1-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]piperidin-3-ol
CID 110883667
N-(1-methylazepan-4-yl)-2-(5-methyl-2-thiophen-3-yl-1,3-oxazol-4-yl)acetamide
CID 166298149
1-[(2R)-2,4-dimethylpiperazin-1-yl]-2-(5-methyl-2-thiophen-3-yl-1,3-oxazol-4-yl)ethanone
CID 97066582

Frequently Asked Questions

What is the IUPAC name of 1-[(5-methyl-2-thiophen-3-yl-1,3-oxazol-4-yl)methyl]piperidin-4-ol?
The IUPAC name of 1-[(5-methyl-2-thiophen-3-yl-1,3-oxazol-4-yl)methyl]piperidin-4-ol (CID 110923157) is 1-[(5-methyl-2-thiophen-3-yl-1,3-oxazol-4-yl)methyl]piperidin-4-ol.
What is the SMILES notation for 1-[(5-methyl-2-thiophen-3-yl-1,3-oxazol-4-yl)methyl]piperidin-4-ol?
The canonical SMILES for 1-[(5-methyl-2-thiophen-3-yl-1,3-oxazol-4-yl)methyl]piperidin-4-ol is Cc1oc(-c2ccsc2)nc1CN1CCC(O)CC1.
What is the InChIKey of 1-[(5-methyl-2-thiophen-3-yl-1,3-oxazol-4-yl)methyl]piperidin-4-ol?
The InChIKey is UKWIVIVYNWAMQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O2S/c1-10-13(8-16-5-2-12(17)3-6-16)15-14(18-10)11-4-7-19-9-11/h4,7,9,12,17H,2-3,5-6,8H2,1H3.
What are the key properties of 1-[(5-methyl-2-thiophen-3-yl-1,3-oxazol-4-yl)methyl]piperidin-4-ol?
1-[(5-methyl-2-thiophen-3-yl-1,3-oxazol-4-yl)methyl]piperidin-4-ol has a molecular weight of 278.38 g/mol, XLogP of 2.67, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(5-methyl-2-thiophen-3-yl-1,3-oxazol-4-yl)methyl]piperidin-4-ol is sourced from PubChem (CID 110923157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).