2,2,6,6-tetramethyl-N-[(2-pyridin-2-yl-1,3-thiazol-4-yl)methyl]piperidin-4-amine

C18H26N4S — CID 119114785

IUPAC2,2,6,6-tetramethyl-N-[(2-pyridin-2-yl-1,3-thiazol-4-yl)methyl]piperidin-4-amine
SMILESCC1(C)CC(NCc2csc(-c3ccccn3)n2)CC(C)(C)N1
InChIInChI=1S/C18H26N4S/c1-17(2)9-13(10-18(3,4)22-17)20-11-14-12-23-16(21-14)15-7-5-6-8-19-15/h5-8,12-13,20,22H,9-11H2,1-4H3
InChIKeyAHMBZXRATZXNBV-UHFFFAOYSA-N
MW330.50 g/mol
LogP3.60
Rot. Bonds4

About 2,2,6,6-tetramethyl-N-[(2-pyridin-2-yl-1,3-thiazol-4-yl)methyl]piperidin-4-amine

2,2,6,6-tetramethyl-N-[(2-pyridin-2-yl-1,3-thiazol-4-yl)methyl]piperidin-4-amine (PubChem CID 119114785) has the molecular formula C18H26N4S and a molecular weight of 330.50 g/mol. Its IUPAC name is 2,2,6,6-tetramethyl-N-[(2-pyridin-2-yl-1,3-thiazol-4-yl)methyl]piperidin-4-amine.

Molecular Properties

Compound Name2,2,6,6-tetramethyl-N-[(2-pyridin-2-yl-1,3-thiazol-4-yl)methyl]piperidin-4-amine
PubChem CID119114785
Molecular FormulaC18H26N4S
Molecular Weight330.50 g/mol
Exact Mass330.19
IUPAC Name2,2,6,6-tetramethyl-N-[(2-pyridin-2-yl-1,3-thiazol-4-yl)methyl]piperidin-4-amine
SMILESCC1(C)CC(NCc2csc(-c3ccccn3)n2)CC(C)(C)N1
InChIInChI=1S/C18H26N4S/c1-17(2)9-13(10-18(3,4)22-17)20-11-14-12-23-16(21-14)15-7-5-6-8-19-15/h5-8,12-13,20,22H,9-11H2,1-4H3
InChIKeyAHMBZXRATZXNBV-UHFFFAOYSA-N
XLogP3.60
TPSA49.84 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.50
LogP ≤ 53.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2,2,6,6-tetramethyl-N-[(2-pyridin-2-yl-1,3-thiazol-4-yl)methyl]piperidin-4-amine?
The IUPAC name of 2,2,6,6-tetramethyl-N-[(2-pyridin-2-yl-1,3-thiazol-4-yl)methyl]piperidin-4-amine (CID 119114785) is 2,2,6,6-tetramethyl-N-[(2-pyridin-2-yl-1,3-thiazol-4-yl)methyl]piperidin-4-amine.
What is the SMILES notation for 2,2,6,6-tetramethyl-N-[(2-pyridin-2-yl-1,3-thiazol-4-yl)methyl]piperidin-4-amine?
The canonical SMILES for 2,2,6,6-tetramethyl-N-[(2-pyridin-2-yl-1,3-thiazol-4-yl)methyl]piperidin-4-amine is CC1(C)CC(NCc2csc(-c3ccccn3)n2)CC(C)(C)N1.
What is the InChIKey of 2,2,6,6-tetramethyl-N-[(2-pyridin-2-yl-1,3-thiazol-4-yl)methyl]piperidin-4-amine?
The InChIKey is AHMBZXRATZXNBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N4S/c1-17(2)9-13(10-18(3,4)22-17)20-11-14-12-23-16(21-14)15-7-5-6-8-19-15/h5-8,12-13,20,22H,9-11H2,1-4H3.
What are the key properties of 2,2,6,6-tetramethyl-N-[(2-pyridin-2-yl-1,3-thiazol-4-yl)methyl]piperidin-4-amine?
2,2,6,6-tetramethyl-N-[(2-pyridin-2-yl-1,3-thiazol-4-yl)methyl]piperidin-4-amine has a molecular weight of 330.50 g/mol, XLogP of 3.60, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,6,6-tetramethyl-N-[(2-pyridin-2-yl-1,3-thiazol-4-yl)methyl]piperidin-4-amine is sourced from PubChem (CID 119114785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).