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

C15H26N2OS — CID 111333364

IUPAC1-[1-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]piperidin-2-yl]propan-1-ol
SMILESCCC(O)C1CCCCN1Cc1csc(C(C)C)n1
InChIInChI=1S/C15H26N2OS/c1-4-14(18)13-7-5-6-8-17(13)9-12-10-19-15(16-12)11(2)3/h10-11,13-14,18H,4-9H2,1-3H3
InChIKeyDGDNDLNYXZREAZ-UHFFFAOYSA-N
MW282.45 g/mol
LogP3.39
Rot. Bonds5

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

1-[1-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]piperidin-2-yl]propan-1-ol (PubChem CID 111333364) has the molecular formula C15H26N2OS and a molecular weight of 282.45 g/mol. Its IUPAC name is 1-[1-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]piperidin-2-yl]propan-1-ol.

Molecular Properties

Compound Name1-[1-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]piperidin-2-yl]propan-1-ol
PubChem CID111333364
Molecular FormulaC15H26N2OS
Molecular Weight282.45 g/mol
Exact Mass282.18
IUPAC Name1-[1-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]piperidin-2-yl]propan-1-ol
SMILESCCC(O)C1CCCCN1Cc1csc(C(C)C)n1
InChIInChI=1S/C15H26N2OS/c1-4-14(18)13-7-5-6-8-17(13)9-12-10-19-15(16-12)11(2)3/h10-11,13-14,18H,4-9H2,1-3H3
InChIKeyDGDNDLNYXZREAZ-UHFFFAOYSA-N
XLogP3.39
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.45
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-[1-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]piperidin-2-yl]propan-1-ol with MolForge

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Related Compounds

1-[1-[[2-(1-ethoxyethyl)-1,3-thiazol-4-yl]methyl]piperidin-2-yl]ethanol
CID 111434600
2-[1-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]pyrrolidin-2-yl]cyclopentan-1-ol
CID 114339200
1-[1-(thiophen-3-ylmethyl)piperidin-2-yl]propan-1-ol
CID 115882861
1-[4-[(2-propylpiperidin-1-yl)methyl]-1,3-thiazol-2-yl]ethanamine
CID 83055721
1-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]piperidin-3-ol
CID 51086523
1-[1-[(4-propyl-1,3-thiazol-2-yl)methyl]piperidin-2-yl]ethanamine
CID 120897022
1-[1-[(2-ethyl-1,3-thiazol-4-yl)methyl]azepan-2-yl]propan-2-ol
CID 114338946
N-methyl-1-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]piperidin-4-amine
CID 119923292
N-methyl-1-[1-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]piperidin-4-yl]methanamine
CID 55168538
methyl 2-hydroxy-2-[1-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]piperidin-4-yl]acetate
CID 75431209
N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]cyclohexanecarboxamide
CID 110728045
1-[4-(1-hydroxyethyl)piperidin-1-yl]-2-(2-propan-2-yl-1,3-thiazol-4-yl)ethanone
CID 111429992

Frequently Asked Questions

What is the IUPAC name of 1-[1-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]piperidin-2-yl]propan-1-ol?
The IUPAC name of 1-[1-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]piperidin-2-yl]propan-1-ol (CID 111333364) is 1-[1-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]piperidin-2-yl]propan-1-ol.
What is the SMILES notation for 1-[1-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]piperidin-2-yl]propan-1-ol?
The canonical SMILES for 1-[1-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]piperidin-2-yl]propan-1-ol is CCC(O)C1CCCCN1Cc1csc(C(C)C)n1.
What is the InChIKey of 1-[1-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]piperidin-2-yl]propan-1-ol?
The InChIKey is DGDNDLNYXZREAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2OS/c1-4-14(18)13-7-5-6-8-17(13)9-12-10-19-15(16-12)11(2)3/h10-11,13-14,18H,4-9H2,1-3H3.
What are the key properties of 1-[1-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]piperidin-2-yl]propan-1-ol?
1-[1-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]piperidin-2-yl]propan-1-ol has a molecular weight of 282.45 g/mol, XLogP of 3.39, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]piperidin-2-yl]propan-1-ol is sourced from PubChem (CID 111333364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).