N-ethyl-4-methyl-5-[1-(methylamino)ethyl]-N-(pyridin-4-ylmethyl)-1,3-thiazol-2-amine

C15H22N4S — CID 62753060

IUPACN-ethyl-4-methyl-5-[1-(methylamino)ethyl]-N-(pyridin-4-ylmethyl)-1,3-thiazol-2-amine
SMILESCCN(Cc1ccncc1)c1nc(C)c(C(C)NC)s1
InChIInChI=1S/C15H22N4S/c1-5-19(10-13-6-8-17-9-7-13)15-18-12(3)14(20-15)11(2)16-4/h6-9,11,16H,5,10H2,1-4H3
InChIKeyMWAURBFECUXIMD-UHFFFAOYSA-N
MW290.44 g/mol
LogP3.15
Rot. Bonds6

About N-ethyl-4-methyl-5-[1-(methylamino)ethyl]-N-(pyridin-4-ylmethyl)-1,3-thiazol-2-amine

N-ethyl-4-methyl-5-[1-(methylamino)ethyl]-N-(pyridin-4-ylmethyl)-1,3-thiazol-2-amine (PubChem CID 62753060) has the molecular formula C15H22N4S and a molecular weight of 290.44 g/mol. Its IUPAC name is N-ethyl-4-methyl-5-[1-(methylamino)ethyl]-N-(pyridin-4-ylmethyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-ethyl-4-methyl-5-[1-(methylamino)ethyl]-N-(pyridin-4-ylmethyl)-1,3-thiazol-2-amine
PubChem CID62753060
Molecular FormulaC15H22N4S
Molecular Weight290.44 g/mol
Exact Mass290.16
IUPAC NameN-ethyl-4-methyl-5-[1-(methylamino)ethyl]-N-(pyridin-4-ylmethyl)-1,3-thiazol-2-amine
SMILESCCN(Cc1ccncc1)c1nc(C)c(C(C)NC)s1
InChIInChI=1S/C15H22N4S/c1-5-19(10-13-6-8-17-9-7-13)15-18-12(3)14(20-15)11(2)16-4/h6-9,11,16H,5,10H2,1-4H3
InChIKeyMWAURBFECUXIMD-UHFFFAOYSA-N
XLogP3.15
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.44
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-methyl-5-[1-(methylamino)ethyl]-N-(pyridin-4-ylmethyl)-1,3-thiazol-2-amine?
The IUPAC name of N-ethyl-4-methyl-5-[1-(methylamino)ethyl]-N-(pyridin-4-ylmethyl)-1,3-thiazol-2-amine (CID 62753060) is N-ethyl-4-methyl-5-[1-(methylamino)ethyl]-N-(pyridin-4-ylmethyl)-1,3-thiazol-2-amine.
What is the SMILES notation for N-ethyl-4-methyl-5-[1-(methylamino)ethyl]-N-(pyridin-4-ylmethyl)-1,3-thiazol-2-amine?
The canonical SMILES for N-ethyl-4-methyl-5-[1-(methylamino)ethyl]-N-(pyridin-4-ylmethyl)-1,3-thiazol-2-amine is CCN(Cc1ccncc1)c1nc(C)c(C(C)NC)s1.
What is the InChIKey of N-ethyl-4-methyl-5-[1-(methylamino)ethyl]-N-(pyridin-4-ylmethyl)-1,3-thiazol-2-amine?
The InChIKey is MWAURBFECUXIMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4S/c1-5-19(10-13-6-8-17-9-7-13)15-18-12(3)14(20-15)11(2)16-4/h6-9,11,16H,5,10H2,1-4H3.
What are the key properties of N-ethyl-4-methyl-5-[1-(methylamino)ethyl]-N-(pyridin-4-ylmethyl)-1,3-thiazol-2-amine?
N-ethyl-4-methyl-5-[1-(methylamino)ethyl]-N-(pyridin-4-ylmethyl)-1,3-thiazol-2-amine has a molecular weight of 290.44 g/mol, XLogP of 3.15, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-methyl-5-[1-(methylamino)ethyl]-N-(pyridin-4-ylmethyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 62753060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).