5,5-diethyl-N-[(5-ethylthiophen-2-yl)methyl]-4,6-dihydro-1,3-thiazin-2-amine

C15H24N2S2 — CID 106252065

IUPAC5,5-diethyl-N-[(5-ethylthiophen-2-yl)methyl]-4,6-dihydro-1,3-thiazin-2-amine
SMILESCCc1ccc(CNC2=NCC(CC)(CC)CS2)s1
InChIInChI=1S/C15H24N2S2/c1-4-12-7-8-13(19-12)9-16-14-17-10-15(5-2,6-3)11-18-14/h7-8H,4-6,9-11H2,1-3H3,(H,16,17)
InChIKeyAOGAZWXNZYKQQK-UHFFFAOYSA-N
MW296.50 g/mol
LogP4.31
Rot. Bonds5

About 5,5-diethyl-N-[(5-ethylthiophen-2-yl)methyl]-4,6-dihydro-1,3-thiazin-2-amine

5,5-diethyl-N-[(5-ethylthiophen-2-yl)methyl]-4,6-dihydro-1,3-thiazin-2-amine (PubChem CID 106252065) has the molecular formula C15H24N2S2 and a molecular weight of 296.50 g/mol. Its IUPAC name is 5,5-diethyl-N-[(5-ethylthiophen-2-yl)methyl]-4,6-dihydro-1,3-thiazin-2-amine.

Molecular Properties

Compound Name5,5-diethyl-N-[(5-ethylthiophen-2-yl)methyl]-4,6-dihydro-1,3-thiazin-2-amine
PubChem CID106252065
Molecular FormulaC15H24N2S2
Molecular Weight296.50 g/mol
Exact Mass296.14
IUPAC Name5,5-diethyl-N-[(5-ethylthiophen-2-yl)methyl]-4,6-dihydro-1,3-thiazin-2-amine
SMILESCCc1ccc(CNC2=NCC(CC)(CC)CS2)s1
InChIInChI=1S/C15H24N2S2/c1-4-12-7-8-13(19-12)9-16-14-17-10-15(5-2,6-3)11-18-14/h7-8H,4-6,9-11H2,1-3H3,(H,16,17)
InChIKeyAOGAZWXNZYKQQK-UHFFFAOYSA-N
XLogP4.31
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.50
LogP ≤ 54.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5,5-diethyl-N-(1,3-thiazol-2-ylmethyl)-4,6-dihydro-1,3-thiazin-2-amine
CID 106250447
4-[[(5,5-diethyl-4,6-dihydro-1,3-thiazin-2-yl)amino]methyl]-3H-1,3-thiazol-2-one
CID 114181657
5-cyclopropyl-N-[(5-ethylthiophen-2-yl)methyl]-4,5-dihydro-1,3-thiazol-2-amine
CID 106014087
5,5-diethyl-N-[(4-ethylcyclohexyl)methyl]-4,6-dihydro-1,3-thiazin-2-amine
CID 106250589
5,5-diethyl-N-[[1-(2-methylpropyl)cyclopentyl]methyl]-4,6-dihydro-1,3-thiazin-2-amine
CID 106251174
5,5-diethyl-N-(2-pyrrolidin-1-ylethyl)-4,6-dihydro-1,3-thiazin-2-amine
CID 114164083
1-N-(5,5-diethyl-4,6-dihydro-1,3-thiazin-2-yl)-2-N,2-N-dimethylbenzene-1,2-diamine
CID 106251711
N-(3-bromo-4-methylphenyl)-5,5-diethyl-4,6-dihydro-1,3-thiazin-2-amine
CID 106250889
N-[(5-ethylthiophen-2-yl)methyl]-5-(2-methylpropyl)-4,5-dihydro-1,3-thiazol-2-amine
CID 106014089
4-[(5,5-diethyl-4,6-dihydro-1,3-thiazin-2-yl)amino]benzene-1,2-dicarbonitrile
CID 106251814
N-(2-ethoxyphenyl)-5,5-diethyl-4,6-dihydro-1,3-thiazin-2-amine
CID 106249725
N-[(5-ethylthiophen-2-yl)methyl]-2,3-dihydro-1-benzofuran-5-amine
CID 62345020

Frequently Asked Questions

What is the IUPAC name of 5,5-diethyl-N-[(5-ethylthiophen-2-yl)methyl]-4,6-dihydro-1,3-thiazin-2-amine?
The IUPAC name of 5,5-diethyl-N-[(5-ethylthiophen-2-yl)methyl]-4,6-dihydro-1,3-thiazin-2-amine (CID 106252065) is 5,5-diethyl-N-[(5-ethylthiophen-2-yl)methyl]-4,6-dihydro-1,3-thiazin-2-amine.
What is the SMILES notation for 5,5-diethyl-N-[(5-ethylthiophen-2-yl)methyl]-4,6-dihydro-1,3-thiazin-2-amine?
The canonical SMILES for 5,5-diethyl-N-[(5-ethylthiophen-2-yl)methyl]-4,6-dihydro-1,3-thiazin-2-amine is CCc1ccc(CNC2=NCC(CC)(CC)CS2)s1.
What is the InChIKey of 5,5-diethyl-N-[(5-ethylthiophen-2-yl)methyl]-4,6-dihydro-1,3-thiazin-2-amine?
The InChIKey is AOGAZWXNZYKQQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2S2/c1-4-12-7-8-13(19-12)9-16-14-17-10-15(5-2,6-3)11-18-14/h7-8H,4-6,9-11H2,1-3H3,(H,16,17).
What are the key properties of 5,5-diethyl-N-[(5-ethylthiophen-2-yl)methyl]-4,6-dihydro-1,3-thiazin-2-amine?
5,5-diethyl-N-[(5-ethylthiophen-2-yl)methyl]-4,6-dihydro-1,3-thiazin-2-amine has a molecular weight of 296.50 g/mol, XLogP of 4.31, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5-diethyl-N-[(5-ethylthiophen-2-yl)methyl]-4,6-dihydro-1,3-thiazin-2-amine is sourced from PubChem (CID 106252065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).