4-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-1-methyl-N-propylpiperidin-4-amine

C15H27N3S — CID 61336145

IUPAC4-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-1-methyl-N-propylpiperidin-4-amine
SMILESCCCNC1(c2nc(CC)c(C)s2)CCN(C)CC1
InChIInChI=1S/C15H27N3S/c1-5-9-16-15(7-10-18(4)11-8-15)14-17-13(6-2)12(3)19-14/h16H,5-11H2,1-4H3
InChIKeyWKPPIADIJUKQDK-UHFFFAOYSA-N
MW281.47 g/mol
LogP2.93
Rot. Bonds5

About 4-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-1-methyl-N-propylpiperidin-4-amine

4-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-1-methyl-N-propylpiperidin-4-amine (PubChem CID 61336145) has the molecular formula C15H27N3S and a molecular weight of 281.47 g/mol. Its IUPAC name is 4-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-1-methyl-N-propylpiperidin-4-amine.

Molecular Properties

Compound Name4-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-1-methyl-N-propylpiperidin-4-amine
PubChem CID61336145
Molecular FormulaC15H27N3S
Molecular Weight281.47 g/mol
Exact Mass281.19
IUPAC Name4-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-1-methyl-N-propylpiperidin-4-amine
SMILESCCCNC1(c2nc(CC)c(C)s2)CCN(C)CC1
InChIInChI=1S/C15H27N3S/c1-5-9-16-15(7-10-18(4)11-8-15)14-17-13(6-2)12(3)19-14/h16H,5-11H2,1-4H3
InChIKeyWKPPIADIJUKQDK-UHFFFAOYSA-N
XLogP2.93
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.47
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-1-methyl-N-propylpiperidin-4-amine?
The IUPAC name of 4-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-1-methyl-N-propylpiperidin-4-amine (CID 61336145) is 4-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-1-methyl-N-propylpiperidin-4-amine.
What is the SMILES notation for 4-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-1-methyl-N-propylpiperidin-4-amine?
The canonical SMILES for 4-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-1-methyl-N-propylpiperidin-4-amine is CCCNC1(c2nc(CC)c(C)s2)CCN(C)CC1.
What is the InChIKey of 4-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-1-methyl-N-propylpiperidin-4-amine?
The InChIKey is WKPPIADIJUKQDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3S/c1-5-9-16-15(7-10-18(4)11-8-15)14-17-13(6-2)12(3)19-14/h16H,5-11H2,1-4H3.
What are the key properties of 4-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-1-methyl-N-propylpiperidin-4-amine?
4-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-1-methyl-N-propylpiperidin-4-amine has a molecular weight of 281.47 g/mol, XLogP of 2.93, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-1-methyl-N-propylpiperidin-4-amine is sourced from PubChem (CID 61336145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).