N-[[2-(3-methoxy-3-methylpiperidin-1-yl)-1,3-thiazol-4-yl]methyl]-2-methylpropan-2-amine

C15H27N3OS — CID 107395922

IUPACN-[[2-(3-methoxy-3-methylpiperidin-1-yl)-1,3-thiazol-4-yl]methyl]-2-methylpropan-2-amine
SMILESCOC1(C)CCCN(c2nc(CNC(C)(C)C)cs2)C1
InChIInChI=1S/C15H27N3OS/c1-14(2,3)16-9-12-10-20-13(17-12)18-8-6-7-15(4,11-18)19-5/h10,16H,6-9,11H2,1-5H3
InChIKeyGDPKWQBQHKOYBC-UHFFFAOYSA-N
MW297.47 g/mol
LogP3.04
Rot. Bonds4

About N-[[2-(3-methoxy-3-methylpiperidin-1-yl)-1,3-thiazol-4-yl]methyl]-2-methylpropan-2-amine

N-[[2-(3-methoxy-3-methylpiperidin-1-yl)-1,3-thiazol-4-yl]methyl]-2-methylpropan-2-amine (PubChem CID 107395922) has the molecular formula C15H27N3OS and a molecular weight of 297.47 g/mol. Its IUPAC name is N-[[2-(3-methoxy-3-methylpiperidin-1-yl)-1,3-thiazol-4-yl]methyl]-2-methylpropan-2-amine.

Molecular Properties

Compound NameN-[[2-(3-methoxy-3-methylpiperidin-1-yl)-1,3-thiazol-4-yl]methyl]-2-methylpropan-2-amine
PubChem CID107395922
Molecular FormulaC15H27N3OS
Molecular Weight297.47 g/mol
Exact Mass297.19
IUPAC NameN-[[2-(3-methoxy-3-methylpiperidin-1-yl)-1,3-thiazol-4-yl]methyl]-2-methylpropan-2-amine
SMILESCOC1(C)CCCN(c2nc(CNC(C)(C)C)cs2)C1
InChIInChI=1S/C15H27N3OS/c1-14(2,3)16-9-12-10-20-13(17-12)18-8-6-7-15(4,11-18)19-5/h10,16H,6-9,11H2,1-5H3
InChIKeyGDPKWQBQHKOYBC-UHFFFAOYSA-N
XLogP3.04
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.47
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[[2-(3-methoxy-3-methylpiperidin-1-yl)-1,3-thiazol-4-yl]methyl]-2-methylpropan-2-amine with MolForge

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Related Compounds

2-methoxy-N-[[2-(3-methoxy-3-methylpiperidin-1-yl)-1,3-thiazol-4-yl]methyl]ethanamine
CID 107395917
N-[[5-(3-methoxy-3-methylpiperidin-1-yl)-1,3,4-oxadiazol-2-yl]methyl]-2-methylpropan-2-amine
CID 107396649
N-[[3-(3-methoxy-3-methylpiperidin-1-yl)-4-pyridinyl]methyl]-2-methylpropan-2-amine
CID 107395279
4-(chloromethyl)-2-(3-methoxy-3-methylazetidin-1-yl)-1,3-thiazole
CID 130964274
N-[[2-(3-methoxy-3-methylpiperidin-1-yl)-4-propyl-1,3-thiazol-5-yl]methyl]ethanamine
CID 107395753
N-[[4-[(3-methoxy-3-methylpiperidin-1-yl)methyl]-1,3-thiazol-2-yl]methyl]ethanamine
CID 107395568
1-[2-ethyl-6-(3-methoxy-3-methylpiperidin-1-yl)-4-pyridinyl]-N-methylmethanamine
CID 107395291
N-[[4-(3-methoxy-3-methylpiperidin-1-yl)phenyl]methyl]-2-methylpropan-1-amine
CID 107393813
2-(3-methoxy-3-methylpiperidin-1-yl)-4-propyl-1,3-thiazole-5-carbaldehyde
CID 107395732
1-[6-(3-methoxy-3-methylpiperidin-1-yl)pyridazin-3-yl]-N-methylmethanamine
CID 107395284
4-chloro-2-(3-methoxy-3-methylpiperidin-1-yl)-1,3-thiazole-5-carbaldehyde
CID 107393347
N-[[6-(3-methoxy-3-methylpiperidin-1-yl)pyrazin-2-yl]methyl]propan-1-amine
CID 107395302

Frequently Asked Questions

What is the IUPAC name of N-[[2-(3-methoxy-3-methylpiperidin-1-yl)-1,3-thiazol-4-yl]methyl]-2-methylpropan-2-amine?
The IUPAC name of N-[[2-(3-methoxy-3-methylpiperidin-1-yl)-1,3-thiazol-4-yl]methyl]-2-methylpropan-2-amine (CID 107395922) is N-[[2-(3-methoxy-3-methylpiperidin-1-yl)-1,3-thiazol-4-yl]methyl]-2-methylpropan-2-amine.
What is the SMILES notation for N-[[2-(3-methoxy-3-methylpiperidin-1-yl)-1,3-thiazol-4-yl]methyl]-2-methylpropan-2-amine?
The canonical SMILES for N-[[2-(3-methoxy-3-methylpiperidin-1-yl)-1,3-thiazol-4-yl]methyl]-2-methylpropan-2-amine is COC1(C)CCCN(c2nc(CNC(C)(C)C)cs2)C1.
What is the InChIKey of N-[[2-(3-methoxy-3-methylpiperidin-1-yl)-1,3-thiazol-4-yl]methyl]-2-methylpropan-2-amine?
The InChIKey is GDPKWQBQHKOYBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3OS/c1-14(2,3)16-9-12-10-20-13(17-12)18-8-6-7-15(4,11-18)19-5/h10,16H,6-9,11H2,1-5H3.
What are the key properties of N-[[2-(3-methoxy-3-methylpiperidin-1-yl)-1,3-thiazol-4-yl]methyl]-2-methylpropan-2-amine?
N-[[2-(3-methoxy-3-methylpiperidin-1-yl)-1,3-thiazol-4-yl]methyl]-2-methylpropan-2-amine has a molecular weight of 297.47 g/mol, XLogP of 3.04, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(3-methoxy-3-methylpiperidin-1-yl)-1,3-thiazol-4-yl]methyl]-2-methylpropan-2-amine is sourced from PubChem (CID 107395922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).