6-methyl-3-piperidin-4-ylthieno[2,3-d][1,2]oxazole;hydrochloride

C11H15ClN2OS — CID 23112449

IUPAC6-methyl-3-piperidin-4-ylthieno[2,3-d][1,2]oxazole;hydrochloride
SMILESCc1csc2c(C3CCNCC3)noc12.Cl
InChIInChI=1S/C11H14N2OS.ClH/c1-7-6-15-11-9(13-14-10(7)11)8-2-4-12-5-3-8;/h6,8,12H,2-5H2,1H3;1H
InChIKeyHVETXZJZIVVNGS-UHFFFAOYSA-N
MW258.77 g/mol
LogP3.09
Rot. Bonds1

About 6-methyl-3-piperidin-4-ylthieno[2,3-d][1,2]oxazole;hydrochloride

6-methyl-3-piperidin-4-ylthieno[2,3-d][1,2]oxazole;hydrochloride (PubChem CID 23112449) has the molecular formula C11H15ClN2OS and a molecular weight of 258.77 g/mol. Its IUPAC name is 6-methyl-3-piperidin-4-ylthieno[2,3-d][1,2]oxazole;hydrochloride.

Molecular Properties

Compound Name6-methyl-3-piperidin-4-ylthieno[2,3-d][1,2]oxazole;hydrochloride
PubChem CID23112449
Molecular FormulaC11H15ClN2OS
Molecular Weight258.77 g/mol
Exact Mass258.06
IUPAC Name6-methyl-3-piperidin-4-ylthieno[2,3-d][1,2]oxazole;hydrochloride
SMILESCc1csc2c(C3CCNCC3)noc12.Cl
InChIInChI=1S/C11H14N2OS.ClH/c1-7-6-15-11-9(13-14-10(7)11)8-2-4-12-5-3-8;/h6,8,12H,2-5H2,1H3;1H
InChIKeyHVETXZJZIVVNGS-UHFFFAOYSA-N
XLogP3.09
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.77
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

tert-butyl 4-(3-bromo-4-methylthiophene-2-carbonyl)piperidine-1-carboxylate;6-methyl-3-piperidin-4-ylthieno[2,3-d][1,2]oxazole;hydrochloride
CID 157300499
4-methyl-3-piperidin-4-yl-1,2-benzothiazole
CID 18365321
3-piperidin-4-yl-1,2-benzoxazole;hydrochloride
CID 13076437
4,5-dimethyl-3-pyrrolidin-3-yl-1,2-oxazole
CID 82597163
4-methyl-2-piperidin-4-yl-1,3-thiazole
CID 23404938
3-piperidin-4-yl-6,7-dihydro-5H-[1,2]oxazolo[4,5-c]pyridin-4-one;hydrochloride
CID 171688106
6-methoxy-3-piperidin-4-yl-1,2-benzoxazole;hydrochloride
CID 52983604
4-(2-methylphenyl)-2-piperidin-4-yl-1,3-thiazole
CID 55084434
4-(2,5-difluoro-4-methylphenyl)-2-piperidin-4-yl-1,3-thiazole;hydrochloride
CID 120558206
3-methyl-5-(4-piperidin-4-ylpyrimidin-5-yl)-1,2-oxazole
CID 95833537
4-methyl-2-[(3R)-pyrrolidin-3-yl]-1,3-thiazole
CID 93492448
4-(5-methyl-3H-pyrrol-4-yl)piperidine
CID 160571174

Frequently Asked Questions

What is the IUPAC name of 6-methyl-3-piperidin-4-ylthieno[2,3-d][1,2]oxazole;hydrochloride?
The IUPAC name of 6-methyl-3-piperidin-4-ylthieno[2,3-d][1,2]oxazole;hydrochloride (CID 23112449) is 6-methyl-3-piperidin-4-ylthieno[2,3-d][1,2]oxazole;hydrochloride.
What is the SMILES notation for 6-methyl-3-piperidin-4-ylthieno[2,3-d][1,2]oxazole;hydrochloride?
The canonical SMILES for 6-methyl-3-piperidin-4-ylthieno[2,3-d][1,2]oxazole;hydrochloride is Cc1csc2c(C3CCNCC3)noc12.Cl.
What is the InChIKey of 6-methyl-3-piperidin-4-ylthieno[2,3-d][1,2]oxazole;hydrochloride?
The InChIKey is HVETXZJZIVVNGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2OS.ClH/c1-7-6-15-11-9(13-14-10(7)11)8-2-4-12-5-3-8;/h6,8,12H,2-5H2,1H3;1H.
What are the key properties of 6-methyl-3-piperidin-4-ylthieno[2,3-d][1,2]oxazole;hydrochloride?
6-methyl-3-piperidin-4-ylthieno[2,3-d][1,2]oxazole;hydrochloride has a molecular weight of 258.77 g/mol, XLogP of 3.09, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-3-piperidin-4-ylthieno[2,3-d][1,2]oxazole;hydrochloride is sourced from PubChem (CID 23112449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).