1-(2,5-dimethyl-1,3-thiazol-4-yl)-N-methyl-N-(piperidin-2-ylmethyl)ethanamine

C14H25N3S — CID 106622843

IUPAC1-(2,5-dimethyl-1,3-thiazol-4-yl)-N-methyl-N-(piperidin-2-ylmethyl)ethanamine
SMILESCc1nc(C(C)N(C)CC2CCCCN2)c(C)s1
InChIInChI=1S/C14H25N3S/c1-10(14-11(2)18-12(3)16-14)17(4)9-13-7-5-6-8-15-13/h10,13,15H,5-9H2,1-4H3
InChIKeyPIOKMGOJYSVXFE-UHFFFAOYSA-N
MW267.44 g/mol
LogP2.89
Rot. Bonds4

About 1-(2,5-dimethyl-1,3-thiazol-4-yl)-N-methyl-N-(piperidin-2-ylmethyl)ethanamine

1-(2,5-dimethyl-1,3-thiazol-4-yl)-N-methyl-N-(piperidin-2-ylmethyl)ethanamine (PubChem CID 106622843) has the molecular formula C14H25N3S and a molecular weight of 267.44 g/mol. Its IUPAC name is 1-(2,5-dimethyl-1,3-thiazol-4-yl)-N-methyl-N-(piperidin-2-ylmethyl)ethanamine.

Molecular Properties

Compound Name1-(2,5-dimethyl-1,3-thiazol-4-yl)-N-methyl-N-(piperidin-2-ylmethyl)ethanamine
PubChem CID106622843
Molecular FormulaC14H25N3S
Molecular Weight267.44 g/mol
Exact Mass267.18
IUPAC Name1-(2,5-dimethyl-1,3-thiazol-4-yl)-N-methyl-N-(piperidin-2-ylmethyl)ethanamine
SMILESCc1nc(C(C)N(C)CC2CCCCN2)c(C)s1
InChIInChI=1S/C14H25N3S/c1-10(14-11(2)18-12(3)16-14)17(4)9-13-7-5-6-8-15-13/h10,13,15H,5-9H2,1-4H3
InChIKeyPIOKMGOJYSVXFE-UHFFFAOYSA-N
XLogP2.89
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.44
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-1-(3-methylpyrazin-2-yl)-N-(piperidin-2-ylmethyl)ethanamine
CID 114080441
1-(2,4-dimethyl-1,3-thiazol-5-yl)-N-ethyl-N-(piperidin-2-ylmethyl)ethanamine
CID 106622746
N-methyl-N-(piperidin-2-ylmethyl)-1-pyridin-4-ylethanamine
CID 106623108
(1S)-1-(furan-2-yl)-N-methyl-N-[[(2S)-piperidin-2-yl]methyl]ethanamine
CID 97162149
N-methyl-N-(pyrrolidin-2-ylmethyl)-1-(1,3,5-trimethylpyrazol-4-yl)ethanamine
CID 106602715
4,5-dimethyl-N-(piperidin-2-ylmethyl)-N-propan-2-yl-1,3-thiazol-2-amine
CID 106641327
N-[1-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]-N-(pyrrolidin-2-ylmethyl)propan-2-amine
CID 106603240
N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]-N-(piperidin-2-ylmethyl)propan-2-amine
CID 106622163
2-[methyl(piperidin-2-ylmethyl)amino]propanoic acid
CID 106635281
1-(2-methoxyphenyl)-N-methyl-N-(piperidin-2-ylmethyl)ethanamine
CID 106623052
1-(2,4-dimethyl-1,3-thiazol-5-yl)-N-(piperidin-2-ylmethyl)ethanamine
CID 54963110
1-(1,3-benzodioxol-5-yl)-N-methyl-N-(piperidin-2-ylmethyl)ethanamine
CID 106622998

Frequently Asked Questions

What is the IUPAC name of 1-(2,5-dimethyl-1,3-thiazol-4-yl)-N-methyl-N-(piperidin-2-ylmethyl)ethanamine?
The IUPAC name of 1-(2,5-dimethyl-1,3-thiazol-4-yl)-N-methyl-N-(piperidin-2-ylmethyl)ethanamine (CID 106622843) is 1-(2,5-dimethyl-1,3-thiazol-4-yl)-N-methyl-N-(piperidin-2-ylmethyl)ethanamine.
What is the SMILES notation for 1-(2,5-dimethyl-1,3-thiazol-4-yl)-N-methyl-N-(piperidin-2-ylmethyl)ethanamine?
The canonical SMILES for 1-(2,5-dimethyl-1,3-thiazol-4-yl)-N-methyl-N-(piperidin-2-ylmethyl)ethanamine is Cc1nc(C(C)N(C)CC2CCCCN2)c(C)s1.
What is the InChIKey of 1-(2,5-dimethyl-1,3-thiazol-4-yl)-N-methyl-N-(piperidin-2-ylmethyl)ethanamine?
The InChIKey is PIOKMGOJYSVXFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3S/c1-10(14-11(2)18-12(3)16-14)17(4)9-13-7-5-6-8-15-13/h10,13,15H,5-9H2,1-4H3.
What are the key properties of 1-(2,5-dimethyl-1,3-thiazol-4-yl)-N-methyl-N-(piperidin-2-ylmethyl)ethanamine?
1-(2,5-dimethyl-1,3-thiazol-4-yl)-N-methyl-N-(piperidin-2-ylmethyl)ethanamine has a molecular weight of 267.44 g/mol, XLogP of 2.89, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,5-dimethyl-1,3-thiazol-4-yl)-N-methyl-N-(piperidin-2-ylmethyl)ethanamine is sourced from PubChem (CID 106622843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).