4-methyl-5-N-(2-thiomorpholin-4-ylethyl)-1,2-thiazole-3,5-diamine

C10H18N4S2 — CID 106327709

IUPAC4-methyl-5-N-(2-thiomorpholin-4-ylethyl)-1,2-thiazole-3,5-diamine
SMILESCc1c(N)nsc1NCCN1CCSCC1
InChIInChI=1S/C10H18N4S2/c1-8-9(11)13-16-10(8)12-2-3-14-4-6-15-7-5-14/h12H,2-7H2,1H3,(H2,11,13)
InChIKeyOPOWEWQUJHSYEY-UHFFFAOYSA-N
MW258.42 g/mol
LogP1.49
Rot. Bonds4

About 4-methyl-5-N-(2-thiomorpholin-4-ylethyl)-1,2-thiazole-3,5-diamine

4-methyl-5-N-(2-thiomorpholin-4-ylethyl)-1,2-thiazole-3,5-diamine (PubChem CID 106327709) has the molecular formula C10H18N4S2 and a molecular weight of 258.42 g/mol. Its IUPAC name is 4-methyl-5-N-(2-thiomorpholin-4-ylethyl)-1,2-thiazole-3,5-diamine.

Molecular Properties

Compound Name4-methyl-5-N-(2-thiomorpholin-4-ylethyl)-1,2-thiazole-3,5-diamine
PubChem CID106327709
Molecular FormulaC10H18N4S2
Molecular Weight258.42 g/mol
Exact Mass258.10
IUPAC Name4-methyl-5-N-(2-thiomorpholin-4-ylethyl)-1,2-thiazole-3,5-diamine
SMILESCc1c(N)nsc1NCCN1CCSCC1
InChIInChI=1S/C10H18N4S2/c1-8-9(11)13-16-10(8)12-2-3-14-4-6-15-7-5-14/h12H,2-7H2,1H3,(H2,11,13)
InChIKeyOPOWEWQUJHSYEY-UHFFFAOYSA-N
XLogP1.49
TPSA54.18 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.42
LogP ≤ 51.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

4-ethoxy-5-N-(2-thiomorpholin-4-ylethyl)-1,2-thiazole-3,5-diamine
CID 106327712
3-amino-N-methyl-5-(2-thiomorpholin-4-ylethylamino)-1,2-thiazole-4-carboxamide
CID 106327720
4-methyl-5-N-[(1-methylpiperidin-4-yl)methyl]-1,2-thiazole-3,5-diamine
CID 103360229
5-N-[2-(4-methylpiperazin-1-yl)ethyl]-4-methylsulfonyl-1,2-thiazole-3,5-diamine
CID 103383159
2-ethyl-5-methyl-4-N-(2-thiomorpholin-4-ylethyl)pyrimidine-4,6-diamine
CID 106327553
4-methyl-5-N-[2-(triazol-1-yl)ethyl]-1,2-thiazole-3,5-diamine
CID 103365106
5-N-(2-imidazol-1-ylethyl)-4-methyl-1,2-thiazole-3,5-diamine
CID 103359501
5-N-[(1,4-dimethylpiperazin-2-yl)methyl]-4-methyl-1,2-thiazole-3,5-diamine
CID 103361725
3-bromo-4-methyl-2-N-(2-thiomorpholin-4-ylethyl)pyridine-2,5-diamine
CID 114173719
2-methyl-4-N-(2-thiomorpholin-4-ylethyl)pyrimidine-4,6-diamine
CID 114174035
ethyl 3-amino-5-[2-(azepan-1-yl)ethylamino]-1,2-thiazole-4-carboxylate
CID 103378467
5-N-[2-(azepan-1-yl)ethyl]-4-ethylsulfonyl-1,2-thiazole-3,5-diamine
CID 103359429

Frequently Asked Questions

What is the IUPAC name of 4-methyl-5-N-(2-thiomorpholin-4-ylethyl)-1,2-thiazole-3,5-diamine?
The IUPAC name of 4-methyl-5-N-(2-thiomorpholin-4-ylethyl)-1,2-thiazole-3,5-diamine (CID 106327709) is 4-methyl-5-N-(2-thiomorpholin-4-ylethyl)-1,2-thiazole-3,5-diamine.
What is the SMILES notation for 4-methyl-5-N-(2-thiomorpholin-4-ylethyl)-1,2-thiazole-3,5-diamine?
The canonical SMILES for 4-methyl-5-N-(2-thiomorpholin-4-ylethyl)-1,2-thiazole-3,5-diamine is Cc1c(N)nsc1NCCN1CCSCC1.
What is the InChIKey of 4-methyl-5-N-(2-thiomorpholin-4-ylethyl)-1,2-thiazole-3,5-diamine?
The InChIKey is OPOWEWQUJHSYEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4S2/c1-8-9(11)13-16-10(8)12-2-3-14-4-6-15-7-5-14/h12H,2-7H2,1H3,(H2,11,13).
What are the key properties of 4-methyl-5-N-(2-thiomorpholin-4-ylethyl)-1,2-thiazole-3,5-diamine?
4-methyl-5-N-(2-thiomorpholin-4-ylethyl)-1,2-thiazole-3,5-diamine has a molecular weight of 258.42 g/mol, XLogP of 1.49, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-5-N-(2-thiomorpholin-4-ylethyl)-1,2-thiazole-3,5-diamine is sourced from PubChem (CID 106327709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).