N-(5,6-dihydro-4H-1,3-thiazin-2-yl)-N'-(2-methoxyethyl)-N'-methylethane-1,2-diamine

C10H21N3OS — CID 62844860

IUPACN-(5,6-dihydro-4H-1,3-thiazin-2-yl)-N'-(2-methoxyethyl)-N'-methylethane-1,2-diamine
SMILESCOCCN(C)CCNC1=NCCCS1
InChIInChI=1S/C10H21N3OS/c1-13(7-8-14-2)6-5-12-10-11-4-3-9-15-10/h3-9H2,1-2H3,(H,11,12)
InChIKeyNASQVKXBHAJLAJ-UHFFFAOYSA-N
MW231.36 g/mol
LogP0.65
Rot. Bonds6

About N-(5,6-dihydro-4H-1,3-thiazin-2-yl)-N'-(2-methoxyethyl)-N'-methylethane-1,2-diamine

N-(5,6-dihydro-4H-1,3-thiazin-2-yl)-N'-(2-methoxyethyl)-N'-methylethane-1,2-diamine (PubChem CID 62844860) has the molecular formula C10H21N3OS and a molecular weight of 231.36 g/mol. Its IUPAC name is N-(5,6-dihydro-4H-1,3-thiazin-2-yl)-N'-(2-methoxyethyl)-N'-methylethane-1,2-diamine.

Molecular Properties

Compound NameN-(5,6-dihydro-4H-1,3-thiazin-2-yl)-N'-(2-methoxyethyl)-N'-methylethane-1,2-diamine
PubChem CID62844860
Molecular FormulaC10H21N3OS
Molecular Weight231.36 g/mol
Exact Mass231.14
IUPAC NameN-(5,6-dihydro-4H-1,3-thiazin-2-yl)-N'-(2-methoxyethyl)-N'-methylethane-1,2-diamine
SMILESCOCCN(C)CCNC1=NCCCS1
InChIInChI=1S/C10H21N3OS/c1-13(7-8-14-2)6-5-12-10-11-4-3-9-15-10/h3-9H2,1-2H3,(H,11,12)
InChIKeyNASQVKXBHAJLAJ-UHFFFAOYSA-N
XLogP0.65
TPSA36.86 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.36
LogP ≤ 50.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(5,6-dihydro-4H-1,3-thiazin-2-yl)-N'-(2-methoxyethyl)-N'-methylethane-1,2-diamine with MolForge

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Related Compounds

N-(2-methoxyethyl)-4,5-dihydro-1,3-thiazol-2-amine
CID 29068043
N'-(2-methoxyethyl)-N'-methyl-N-(5-pentan-3-yl-4,5-dihydro-1,3-thiazol-2-yl)ethane-1,2-diamine
CID 106285221
N'-benzyl-N-(5,6-dihydro-4H-1,3-thiazin-2-yl)-N'-methylpropane-1,3-diamine
CID 29068172
N'-(2-methoxyethyl)-N'-methyl-N-(1-methyl-4,5-dihydroimidazol-2-yl)ethane-1,2-diamine;hydroiodide
CID 120970734
N-(3,6-dichloro-1,2,4-triazin-5-yl)-N'-(2-methoxyethyl)-N'-methylethane-1,2-diamine
CID 81035370
6-chloro-2-N-[2-[2-methoxyethyl(methyl)amino]ethyl]-4-N-methyl-1,3,5-triazine-2,4-diamine
CID 80824728
5-[2-[2-methoxyethyl(methyl)amino]ethylamino]-3H-1,3,4-thiadiazole-2-thione
CID 62844351
N-(3-chloropyrazin-2-yl)-N'-(2-methoxyethyl)-N'-methylethane-1,2-diamine
CID 62849226
N'-(2-methoxyethyl)-N'-methyl-N-(1,2,4-thiadiazol-5-yl)ethane-1,2-diamine
CID 65273687
N'-(2-methoxyethyl)-N'-methyl-N-pyridin-4-ylethane-1,2-diamine
CID 62844188
N-tert-butyl-N'-(2-methoxyethyl)-N'-methylethane-1,2-diamine
CID 61427619
N-(4,6-dimethoxypyrimidin-2-yl)-N'-(2-methoxyethyl)-N'-methylethane-1,2-diamine
CID 115355108

Frequently Asked Questions

What is the IUPAC name of N-(5,6-dihydro-4H-1,3-thiazin-2-yl)-N'-(2-methoxyethyl)-N'-methylethane-1,2-diamine?
The IUPAC name of N-(5,6-dihydro-4H-1,3-thiazin-2-yl)-N'-(2-methoxyethyl)-N'-methylethane-1,2-diamine (CID 62844860) is N-(5,6-dihydro-4H-1,3-thiazin-2-yl)-N'-(2-methoxyethyl)-N'-methylethane-1,2-diamine.
What is the SMILES notation for N-(5,6-dihydro-4H-1,3-thiazin-2-yl)-N'-(2-methoxyethyl)-N'-methylethane-1,2-diamine?
The canonical SMILES for N-(5,6-dihydro-4H-1,3-thiazin-2-yl)-N'-(2-methoxyethyl)-N'-methylethane-1,2-diamine is COCCN(C)CCNC1=NCCCS1.
What is the InChIKey of N-(5,6-dihydro-4H-1,3-thiazin-2-yl)-N'-(2-methoxyethyl)-N'-methylethane-1,2-diamine?
The InChIKey is NASQVKXBHAJLAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3OS/c1-13(7-8-14-2)6-5-12-10-11-4-3-9-15-10/h3-9H2,1-2H3,(H,11,12).
What are the key properties of N-(5,6-dihydro-4H-1,3-thiazin-2-yl)-N'-(2-methoxyethyl)-N'-methylethane-1,2-diamine?
N-(5,6-dihydro-4H-1,3-thiazin-2-yl)-N'-(2-methoxyethyl)-N'-methylethane-1,2-diamine has a molecular weight of 231.36 g/mol, XLogP of 0.65, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5,6-dihydro-4H-1,3-thiazin-2-yl)-N'-(2-methoxyethyl)-N'-methylethane-1,2-diamine is sourced from PubChem (CID 62844860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).