[1-(1,3-dimethylpyrazolo[5,4-d][1,3]thiazol-5-yl)-4-ethylpiperidin-4-yl]methanol

C14H22N4OS — CID 72858299

IUPAC[1-(1,3-dimethylpyrazolo[5,4-d][1,3]thiazol-5-yl)-4-ethylpiperidin-4-yl]methanol
SMILESCCC1(CO)CCN(c2nc3c(s2)c(C)nn3C)CC1
InChIInChI=1S/C14H22N4OS/c1-4-14(9-19)5-7-18(8-6-14)13-15-12-11(20-13)10(2)16-17(12)3/h19H,4-9H2,1-3H3
InChIKeyOZNREJZHQIRISQ-UHFFFAOYSA-N
MW294.42 g/mol
LogP2.33
Rot. Bonds3

About [1-(1,3-dimethylpyrazolo[5,4-d][1,3]thiazol-5-yl)-4-ethylpiperidin-4-yl]methanol

[1-(1,3-dimethylpyrazolo[5,4-d][1,3]thiazol-5-yl)-4-ethylpiperidin-4-yl]methanol (PubChem CID 72858299) has the molecular formula C14H22N4OS and a molecular weight of 294.42 g/mol. Its IUPAC name is [1-(1,3-dimethylpyrazolo[5,4-d][1,3]thiazol-5-yl)-4-ethylpiperidin-4-yl]methanol.

Molecular Properties

Compound Name[1-(1,3-dimethylpyrazolo[5,4-d][1,3]thiazol-5-yl)-4-ethylpiperidin-4-yl]methanol
PubChem CID72858299
Molecular FormulaC14H22N4OS
Molecular Weight294.42 g/mol
Exact Mass294.15
IUPAC Name[1-(1,3-dimethylpyrazolo[5,4-d][1,3]thiazol-5-yl)-4-ethylpiperidin-4-yl]methanol
SMILESCCC1(CO)CCN(c2nc3c(s2)c(C)nn3C)CC1
InChIInChI=1S/C14H22N4OS/c1-4-14(9-19)5-7-18(8-6-14)13-15-12-11(20-13)10(2)16-17(12)3/h19H,4-9H2,1-3H3
InChIKeyOZNREJZHQIRISQ-UHFFFAOYSA-N
XLogP2.33
TPSA54.18 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.42
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of [1-(1,3-dimethylpyrazolo[5,4-d][1,3]thiazol-5-yl)-4-ethylpiperidin-4-yl]methanol?
The IUPAC name of [1-(1,3-dimethylpyrazolo[5,4-d][1,3]thiazol-5-yl)-4-ethylpiperidin-4-yl]methanol (CID 72858299) is [1-(1,3-dimethylpyrazolo[5,4-d][1,3]thiazol-5-yl)-4-ethylpiperidin-4-yl]methanol.
What is the SMILES notation for [1-(1,3-dimethylpyrazolo[5,4-d][1,3]thiazol-5-yl)-4-ethylpiperidin-4-yl]methanol?
The canonical SMILES for [1-(1,3-dimethylpyrazolo[5,4-d][1,3]thiazol-5-yl)-4-ethylpiperidin-4-yl]methanol is CCC1(CO)CCN(c2nc3c(s2)c(C)nn3C)CC1.
What is the InChIKey of [1-(1,3-dimethylpyrazolo[5,4-d][1,3]thiazol-5-yl)-4-ethylpiperidin-4-yl]methanol?
The InChIKey is OZNREJZHQIRISQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4OS/c1-4-14(9-19)5-7-18(8-6-14)13-15-12-11(20-13)10(2)16-17(12)3/h19H,4-9H2,1-3H3.
What are the key properties of [1-(1,3-dimethylpyrazolo[5,4-d][1,3]thiazol-5-yl)-4-ethylpiperidin-4-yl]methanol?
[1-(1,3-dimethylpyrazolo[5,4-d][1,3]thiazol-5-yl)-4-ethylpiperidin-4-yl]methanol has a molecular weight of 294.42 g/mol, XLogP of 2.33, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(1,3-dimethylpyrazolo[5,4-d][1,3]thiazol-5-yl)-4-ethylpiperidin-4-yl]methanol is sourced from PubChem (CID 72858299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).