5-N-(2-methoxyethyl)-4-methyl-5-N-(2-methylpropyl)-1,2-thiazole-3,5-diamine

C11H21N3OS — CID 103360763

IUPAC5-N-(2-methoxyethyl)-4-methyl-5-N-(2-methylpropyl)-1,2-thiazole-3,5-diamine
SMILESCOCCN(CC(C)C)c1snc(N)c1C
InChIInChI=1S/C11H21N3OS/c1-8(2)7-14(5-6-15-4)11-9(3)10(12)13-16-11/h8H,5-7H2,1-4H3,(H2,12,13)
InChIKeyAEGOFQJLYDHXMX-UHFFFAOYSA-N
MW243.38 g/mol
LogP2.14
Rot. Bonds6

About 5-N-(2-methoxyethyl)-4-methyl-5-N-(2-methylpropyl)-1,2-thiazole-3,5-diamine

5-N-(2-methoxyethyl)-4-methyl-5-N-(2-methylpropyl)-1,2-thiazole-3,5-diamine (PubChem CID 103360763) has the molecular formula C11H21N3OS and a molecular weight of 243.38 g/mol. Its IUPAC name is 5-N-(2-methoxyethyl)-4-methyl-5-N-(2-methylpropyl)-1,2-thiazole-3,5-diamine.

Molecular Properties

Compound Name5-N-(2-methoxyethyl)-4-methyl-5-N-(2-methylpropyl)-1,2-thiazole-3,5-diamine
PubChem CID103360763
Molecular FormulaC11H21N3OS
Molecular Weight243.38 g/mol
Exact Mass243.14
IUPAC Name5-N-(2-methoxyethyl)-4-methyl-5-N-(2-methylpropyl)-1,2-thiazole-3,5-diamine
SMILESCOCCN(CC(C)C)c1snc(N)c1C
InChIInChI=1S/C11H21N3OS/c1-8(2)7-14(5-6-15-4)11-9(3)10(12)13-16-11/h8H,5-7H2,1-4H3,(H2,12,13)
InChIKeyAEGOFQJLYDHXMX-UHFFFAOYSA-N
XLogP2.14
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.38
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-N-(2-methoxyethyl)-5-N-(2-methylpropyl)-4-propylsulfonyl-1,2-thiazole-3,5-diamine
CID 103360766
5-N-(2-methoxyethyl)-5-N-(2-methylpropyl)-4-pyridin-3-yl-1,2-thiazole-3,5-diamine
CID 103360759
5-N-ethyl-5-N-(2-methoxyethyl)-4-methylsulfanyl-1,2-thiazole-3,5-diamine
CID 103361471
5-N,5-N-bis(2-methoxyethyl)-4-methylsulfonyl-1,2-thiazole-3,5-diamine
CID 103380711
5-N-cyclopropyl-4-methyl-5-N-(2-methylpropyl)-1,2-thiazole-3,5-diamine
CID 103361295
5-N,5-N-bis(2-methylpropyl)-4-propan-2-yloxy-1,2-thiazole-3,5-diamine
CID 103360688
methyl 3-amino-5-[2-(dimethylamino)ethyl-(2-methylpropyl)amino]-1,2-thiazole-4-carboxylate
CID 103379735
3-amino-5-[ethyl(2-methoxyethyl)amino]-N-propan-2-yl-1,2-thiazole-4-carboxamide
CID 103380467
5-N-(2-methoxyethyl)-5-N-methyl-4-propan-2-yloxy-1,2-thiazole-3,5-diamine
CID 103361756
2-N-(2-methoxyethyl)-2-N-(2-methylpropyl)-1,3-thiazole-2,5-diamine
CID 102767997
5-N-(2-methoxyethyl)-4-methylsulfanyl-5-N-propan-2-yl-1,2-thiazole-3,5-diamine
CID 103364955
5-N-(2-methoxyethyl)-5-N-propan-2-yl-4-propan-2-yloxy-1,2-thiazole-3,5-diamine
CID 103364962

Frequently Asked Questions

What is the IUPAC name of 5-N-(2-methoxyethyl)-4-methyl-5-N-(2-methylpropyl)-1,2-thiazole-3,5-diamine?
The IUPAC name of 5-N-(2-methoxyethyl)-4-methyl-5-N-(2-methylpropyl)-1,2-thiazole-3,5-diamine (CID 103360763) is 5-N-(2-methoxyethyl)-4-methyl-5-N-(2-methylpropyl)-1,2-thiazole-3,5-diamine.
What is the SMILES notation for 5-N-(2-methoxyethyl)-4-methyl-5-N-(2-methylpropyl)-1,2-thiazole-3,5-diamine?
The canonical SMILES for 5-N-(2-methoxyethyl)-4-methyl-5-N-(2-methylpropyl)-1,2-thiazole-3,5-diamine is COCCN(CC(C)C)c1snc(N)c1C.
What is the InChIKey of 5-N-(2-methoxyethyl)-4-methyl-5-N-(2-methylpropyl)-1,2-thiazole-3,5-diamine?
The InChIKey is AEGOFQJLYDHXMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3OS/c1-8(2)7-14(5-6-15-4)11-9(3)10(12)13-16-11/h8H,5-7H2,1-4H3,(H2,12,13).
What are the key properties of 5-N-(2-methoxyethyl)-4-methyl-5-N-(2-methylpropyl)-1,2-thiazole-3,5-diamine?
5-N-(2-methoxyethyl)-4-methyl-5-N-(2-methylpropyl)-1,2-thiazole-3,5-diamine has a molecular weight of 243.38 g/mol, XLogP of 2.14, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N-(2-methoxyethyl)-4-methyl-5-N-(2-methylpropyl)-1,2-thiazole-3,5-diamine is sourced from PubChem (CID 103360763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).