5-methyl-1-[(2-methyl-1,3-thiazol-4-yl)methyl]piperidin-3-amine

C11H19N3S — CID 79986577

IUPAC5-methyl-1-[(2-methyl-1,3-thiazol-4-yl)methyl]piperidin-3-amine
SMILESCc1nc(CN2CC(C)CC(N)C2)cs1
InChIInChI=1S/C11H19N3S/c1-8-3-10(12)5-14(4-8)6-11-7-15-9(2)13-11/h7-8,10H,3-6,12H2,1-2H3
InChIKeyLWJUYKQRGKOQPT-UHFFFAOYSA-N
MW225.36 g/mol
LogP1.62
Rot. Bonds2

About 5-methyl-1-[(2-methyl-1,3-thiazol-4-yl)methyl]piperidin-3-amine

5-methyl-1-[(2-methyl-1,3-thiazol-4-yl)methyl]piperidin-3-amine (PubChem CID 79986577) has the molecular formula C11H19N3S and a molecular weight of 225.36 g/mol. Its IUPAC name is 5-methyl-1-[(2-methyl-1,3-thiazol-4-yl)methyl]piperidin-3-amine.

Molecular Properties

Compound Name5-methyl-1-[(2-methyl-1,3-thiazol-4-yl)methyl]piperidin-3-amine
PubChem CID79986577
Molecular FormulaC11H19N3S
Molecular Weight225.36 g/mol
Exact Mass225.13
IUPAC Name5-methyl-1-[(2-methyl-1,3-thiazol-4-yl)methyl]piperidin-3-amine
SMILESCc1nc(CN2CC(C)CC(N)C2)cs1
InChIInChI=1S/C11H19N3S/c1-8-3-10(12)5-14(4-8)6-11-7-15-9(2)13-11/h7-8,10H,3-6,12H2,1-2H3
InChIKeyLWJUYKQRGKOQPT-UHFFFAOYSA-N
XLogP1.62
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.36
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-methyl-1-[(2-propyl-1,3-thiazol-4-yl)methyl]piperidin-3-amine
CID 79994218
5-methyl-1-[(2-phenyl-1,3-thiazol-4-yl)methyl]piperidin-3-amine
CID 79992782
4-[[(3aR,6aS)-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrol-5-yl]methyl]-2-methyl-1,3-thiazole;hydrochloride
CID 120661028
2-[1-[(2-methyl-1,3-thiazol-4-yl)methyl]piperidin-3-yl]ethanamine;hydrochloride
CID 120728713
ethane;2-methyl-4-(pyrrolidin-1-ylmethyl)-1,3-thiazole
CID 143966374
2-methyl-4-[(4-methylpiperazin-1-yl)methyl]-1,3-thiazole
CID 18738458
1-[(2-methyl-1,3-thiazol-4-yl)methyl]piperidin-4-ol
CID 60643680
2-(2-chlorophenyl)-4-[(3,5-dimethylpiperidin-1-yl)methyl]-1,3-thiazole
CID 22198040
1-[(2,5-dimethylpyrazol-3-yl)methyl]-5-methylpiperidin-3-amine
CID 79992666
1-[(2-methyl-1,3-thiazol-4-yl)methyl]piperidin-3-ol
CID 60645207
N-methyl-1-[1-[(2-methyl-1,3-thiazol-4-yl)methyl]piperidin-4-yl]methanamine
CID 63250806
N-[[4-[(3,5-dimethylpiperidin-1-yl)methyl]-1,3-thiazol-2-yl]methyl]propan-1-amine
CID 55070041

Frequently Asked Questions

What is the IUPAC name of 5-methyl-1-[(2-methyl-1,3-thiazol-4-yl)methyl]piperidin-3-amine?
The IUPAC name of 5-methyl-1-[(2-methyl-1,3-thiazol-4-yl)methyl]piperidin-3-amine (CID 79986577) is 5-methyl-1-[(2-methyl-1,3-thiazol-4-yl)methyl]piperidin-3-amine.
What is the SMILES notation for 5-methyl-1-[(2-methyl-1,3-thiazol-4-yl)methyl]piperidin-3-amine?
The canonical SMILES for 5-methyl-1-[(2-methyl-1,3-thiazol-4-yl)methyl]piperidin-3-amine is Cc1nc(CN2CC(C)CC(N)C2)cs1.
What is the InChIKey of 5-methyl-1-[(2-methyl-1,3-thiazol-4-yl)methyl]piperidin-3-amine?
The InChIKey is LWJUYKQRGKOQPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3S/c1-8-3-10(12)5-14(4-8)6-11-7-15-9(2)13-11/h7-8,10H,3-6,12H2,1-2H3.
What are the key properties of 5-methyl-1-[(2-methyl-1,3-thiazol-4-yl)methyl]piperidin-3-amine?
5-methyl-1-[(2-methyl-1,3-thiazol-4-yl)methyl]piperidin-3-amine has a molecular weight of 225.36 g/mol, XLogP of 1.62, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-1-[(2-methyl-1,3-thiazol-4-yl)methyl]piperidin-3-amine is sourced from PubChem (CID 79986577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).