2-[2-[(1-ethylpiperidin-2-yl)methyl]-1,3-thiazol-4-yl]propan-1-ol

C14H24N2OS — CID 115088809

IUPAC2-[2-[(1-ethylpiperidin-2-yl)methyl]-1,3-thiazol-4-yl]propan-1-ol
SMILESCCN1CCCCC1Cc1nc(C(C)CO)cs1
InChIInChI=1S/C14H24N2OS/c1-3-16-7-5-4-6-12(16)8-14-15-13(10-18-14)11(2)9-17/h10-12,17H,3-9H2,1-2H3
InChIKeyCLCPSDOPEZATSF-UHFFFAOYSA-N
MW268.43 g/mol
LogP2.66
Rot. Bonds5

About 2-[2-[(1-ethylpiperidin-2-yl)methyl]-1,3-thiazol-4-yl]propan-1-ol

2-[2-[(1-ethylpiperidin-2-yl)methyl]-1,3-thiazol-4-yl]propan-1-ol (PubChem CID 115088809) has the molecular formula C14H24N2OS and a molecular weight of 268.43 g/mol. Its IUPAC name is 2-[2-[(1-ethylpiperidin-2-yl)methyl]-1,3-thiazol-4-yl]propan-1-ol.

Molecular Properties

Compound Name2-[2-[(1-ethylpiperidin-2-yl)methyl]-1,3-thiazol-4-yl]propan-1-ol
PubChem CID115088809
Molecular FormulaC14H24N2OS
Molecular Weight268.43 g/mol
Exact Mass268.16
IUPAC Name2-[2-[(1-ethylpiperidin-2-yl)methyl]-1,3-thiazol-4-yl]propan-1-ol
SMILESCCN1CCCCC1Cc1nc(C(C)CO)cs1
InChIInChI=1S/C14H24N2OS/c1-3-16-7-5-4-6-12(16)8-14-15-13(10-18-14)11(2)9-17/h10-12,17H,3-9H2,1-2H3
InChIKeyCLCPSDOPEZATSF-UHFFFAOYSA-N
XLogP2.66
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.43
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[2-[(1-ethylpiperidin-2-yl)methyl]-1,3-thiazol-4-yl]propan-1-amine
CID 115088807
1-[2-[(1-ethylpyrrolidin-2-yl)methyl]-1,3-thiazol-4-yl]propan-2-ol
CID 115088635
1-[2-[(1-ethylpiperidin-2-yl)methyl]-1,3-thiazol-4-yl]propan-2-one
CID 115088795
2-[2-[(1-methylpiperidin-4-yl)methyl]-1,3-thiazol-4-yl]propan-1-ol
CID 115088116
2-[2-(piperidin-4-ylmethyl)-1,3-thiazol-4-yl]propan-1-ol
CID 115088115
2-[2-[(1-ethylpiperidin-2-yl)methyl]-1,3-thiazol-5-yl]acetic acid
CID 115091040
N-methyl-1-[2-[(1-propan-2-ylpyrrolidin-2-yl)methyl]-1,3-thiazol-4-yl]ethanamine
CID 115088688
1-(1-ethylpiperidin-2-yl)propan-2-ol
CID 21153789
1-[1-[(2-ethyl-1,3-thiazol-4-yl)methyl]azepan-2-yl]propan-2-ol
CID 114338946
2-[2-[(1-propan-2-ylpyrrolidin-2-yl)methyl]-1,3-thiazol-4-yl]ethanol
CID 115088634
2-[2-(thiolan-2-ylmethyl)-1,3-thiazol-4-yl]propan-1-amine
CID 115088655
(1-ethylazepan-2-yl)methanol
CID 2849413

Frequently Asked Questions

What is the IUPAC name of 2-[2-[(1-ethylpiperidin-2-yl)methyl]-1,3-thiazol-4-yl]propan-1-ol?
The IUPAC name of 2-[2-[(1-ethylpiperidin-2-yl)methyl]-1,3-thiazol-4-yl]propan-1-ol (CID 115088809) is 2-[2-[(1-ethylpiperidin-2-yl)methyl]-1,3-thiazol-4-yl]propan-1-ol.
What is the SMILES notation for 2-[2-[(1-ethylpiperidin-2-yl)methyl]-1,3-thiazol-4-yl]propan-1-ol?
The canonical SMILES for 2-[2-[(1-ethylpiperidin-2-yl)methyl]-1,3-thiazol-4-yl]propan-1-ol is CCN1CCCCC1Cc1nc(C(C)CO)cs1.
What is the InChIKey of 2-[2-[(1-ethylpiperidin-2-yl)methyl]-1,3-thiazol-4-yl]propan-1-ol?
The InChIKey is CLCPSDOPEZATSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2OS/c1-3-16-7-5-4-6-12(16)8-14-15-13(10-18-14)11(2)9-17/h10-12,17H,3-9H2,1-2H3.
What are the key properties of 2-[2-[(1-ethylpiperidin-2-yl)methyl]-1,3-thiazol-4-yl]propan-1-ol?
2-[2-[(1-ethylpiperidin-2-yl)methyl]-1,3-thiazol-4-yl]propan-1-ol has a molecular weight of 268.43 g/mol, XLogP of 2.66, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[(1-ethylpiperidin-2-yl)methyl]-1,3-thiazol-4-yl]propan-1-ol is sourced from PubChem (CID 115088809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).