N-(1-ethylpiperidin-4-yl)-N,4-dimethyl-5-[1-(methylamino)ethyl]-1,3-thiazol-2-amine

C15H28N4S — CID 62754118

IUPACN-(1-ethylpiperidin-4-yl)-N,4-dimethyl-5-[1-(methylamino)ethyl]-1,3-thiazol-2-amine
SMILESCCN1CCC(N(C)c2nc(C)c(C(C)NC)s2)CC1
InChIInChI=1S/C15H28N4S/c1-6-19-9-7-13(8-10-19)18(5)15-17-12(3)14(20-15)11(2)16-4/h11,13,16H,6-10H2,1-5H3
InChIKeyZDROMEAGZNBLTP-UHFFFAOYSA-N
MW296.48 g/mol
LogP2.65
Rot. Bonds5

About N-(1-ethylpiperidin-4-yl)-N,4-dimethyl-5-[1-(methylamino)ethyl]-1,3-thiazol-2-amine

N-(1-ethylpiperidin-4-yl)-N,4-dimethyl-5-[1-(methylamino)ethyl]-1,3-thiazol-2-amine (PubChem CID 62754118) has the molecular formula C15H28N4S and a molecular weight of 296.48 g/mol. Its IUPAC name is N-(1-ethylpiperidin-4-yl)-N,4-dimethyl-5-[1-(methylamino)ethyl]-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-(1-ethylpiperidin-4-yl)-N,4-dimethyl-5-[1-(methylamino)ethyl]-1,3-thiazol-2-amine
PubChem CID62754118
Molecular FormulaC15H28N4S
Molecular Weight296.48 g/mol
Exact Mass296.20
IUPAC NameN-(1-ethylpiperidin-4-yl)-N,4-dimethyl-5-[1-(methylamino)ethyl]-1,3-thiazol-2-amine
SMILESCCN1CCC(N(C)c2nc(C)c(C(C)NC)s2)CC1
InChIInChI=1S/C15H28N4S/c1-6-19-9-7-13(8-10-19)18(5)15-17-12(3)14(20-15)11(2)16-4/h11,13,16H,6-10H2,1-5H3
InChIKeyZDROMEAGZNBLTP-UHFFFAOYSA-N
XLogP2.65
TPSA31.40 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.48
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(1-ethylpiperidin-4-yl)-N,4-dimethyl-5-[1-(methylamino)ethyl]-1,3-thiazol-2-amine?
The IUPAC name of N-(1-ethylpiperidin-4-yl)-N,4-dimethyl-5-[1-(methylamino)ethyl]-1,3-thiazol-2-amine (CID 62754118) is N-(1-ethylpiperidin-4-yl)-N,4-dimethyl-5-[1-(methylamino)ethyl]-1,3-thiazol-2-amine.
What is the SMILES notation for N-(1-ethylpiperidin-4-yl)-N,4-dimethyl-5-[1-(methylamino)ethyl]-1,3-thiazol-2-amine?
The canonical SMILES for N-(1-ethylpiperidin-4-yl)-N,4-dimethyl-5-[1-(methylamino)ethyl]-1,3-thiazol-2-amine is CCN1CCC(N(C)c2nc(C)c(C(C)NC)s2)CC1.
What is the InChIKey of N-(1-ethylpiperidin-4-yl)-N,4-dimethyl-5-[1-(methylamino)ethyl]-1,3-thiazol-2-amine?
The InChIKey is ZDROMEAGZNBLTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N4S/c1-6-19-9-7-13(8-10-19)18(5)15-17-12(3)14(20-15)11(2)16-4/h11,13,16H,6-10H2,1-5H3.
What are the key properties of N-(1-ethylpiperidin-4-yl)-N,4-dimethyl-5-[1-(methylamino)ethyl]-1,3-thiazol-2-amine?
N-(1-ethylpiperidin-4-yl)-N,4-dimethyl-5-[1-(methylamino)ethyl]-1,3-thiazol-2-amine has a molecular weight of 296.48 g/mol, XLogP of 2.65, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethylpiperidin-4-yl)-N,4-dimethyl-5-[1-(methylamino)ethyl]-1,3-thiazol-2-amine is sourced from PubChem (CID 62754118), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).