5-[1-(ethylamino)ethyl]-N-methyl-N-(1-methylpiperidin-4-yl)-1,3-thiazol-2-amine

C14H26N4S — CID 55113578

IUPAC5-[1-(ethylamino)ethyl]-N-methyl-N-(1-methylpiperidin-4-yl)-1,3-thiazol-2-amine
SMILESCCNC(C)c1cnc(N(C)C2CCN(C)CC2)s1
InChIInChI=1S/C14H26N4S/c1-5-15-11(2)13-10-16-14(19-13)18(4)12-6-8-17(3)9-7-12/h10-12,15H,5-9H2,1-4H3
InChIKeyYXDQRHUYAPUIFR-UHFFFAOYSA-N
MW282.46 g/mol
LogP2.34
Rot. Bonds5

About 5-[1-(ethylamino)ethyl]-N-methyl-N-(1-methylpiperidin-4-yl)-1,3-thiazol-2-amine

5-[1-(ethylamino)ethyl]-N-methyl-N-(1-methylpiperidin-4-yl)-1,3-thiazol-2-amine (PubChem CID 55113578) has the molecular formula C14H26N4S and a molecular weight of 282.46 g/mol. Its IUPAC name is 5-[1-(ethylamino)ethyl]-N-methyl-N-(1-methylpiperidin-4-yl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-[1-(ethylamino)ethyl]-N-methyl-N-(1-methylpiperidin-4-yl)-1,3-thiazol-2-amine
PubChem CID55113578
Molecular FormulaC14H26N4S
Molecular Weight282.46 g/mol
Exact Mass282.19
IUPAC Name5-[1-(ethylamino)ethyl]-N-methyl-N-(1-methylpiperidin-4-yl)-1,3-thiazol-2-amine
SMILESCCNC(C)c1cnc(N(C)C2CCN(C)CC2)s1
InChIInChI=1S/C14H26N4S/c1-5-15-11(2)13-10-16-14(19-13)18(4)12-6-8-17(3)9-7-12/h10-12,15H,5-9H2,1-4H3
InChIKeyYXDQRHUYAPUIFR-UHFFFAOYSA-N
XLogP2.34
TPSA31.40 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.46
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-[1-(ethylamino)ethyl]-N-methyl-N-(1-methylpiperidin-4-yl)-1,3-thiazol-2-amine?
The IUPAC name of 5-[1-(ethylamino)ethyl]-N-methyl-N-(1-methylpiperidin-4-yl)-1,3-thiazol-2-amine (CID 55113578) is 5-[1-(ethylamino)ethyl]-N-methyl-N-(1-methylpiperidin-4-yl)-1,3-thiazol-2-amine.
What is the SMILES notation for 5-[1-(ethylamino)ethyl]-N-methyl-N-(1-methylpiperidin-4-yl)-1,3-thiazol-2-amine?
The canonical SMILES for 5-[1-(ethylamino)ethyl]-N-methyl-N-(1-methylpiperidin-4-yl)-1,3-thiazol-2-amine is CCNC(C)c1cnc(N(C)C2CCN(C)CC2)s1.
What is the InChIKey of 5-[1-(ethylamino)ethyl]-N-methyl-N-(1-methylpiperidin-4-yl)-1,3-thiazol-2-amine?
The InChIKey is YXDQRHUYAPUIFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4S/c1-5-15-11(2)13-10-16-14(19-13)18(4)12-6-8-17(3)9-7-12/h10-12,15H,5-9H2,1-4H3.
What are the key properties of 5-[1-(ethylamino)ethyl]-N-methyl-N-(1-methylpiperidin-4-yl)-1,3-thiazol-2-amine?
5-[1-(ethylamino)ethyl]-N-methyl-N-(1-methylpiperidin-4-yl)-1,3-thiazol-2-amine has a molecular weight of 282.46 g/mol, XLogP of 2.34, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[1-(ethylamino)ethyl]-N-methyl-N-(1-methylpiperidin-4-yl)-1,3-thiazol-2-amine is sourced from PubChem (CID 55113578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).