2-N-(2-methoxy-1-thiophen-2-ylethyl)-6-methyl-1,3,5-triazine-2,4-diamine

C11H15N5OS — CID 59874344

IUPAC2-N-(2-methoxy-1-thiophen-2-ylethyl)-6-methyl-1,3,5-triazine-2,4-diamine
SMILESCOCC(Nc1nc(C)nc(N)n1)c1cccs1
InChIInChI=1S/C11H15N5OS/c1-7-13-10(12)16-11(14-7)15-8(6-17-2)9-4-3-5-18-9/h3-5,8H,6H2,1-2H3,(H3,12,13,14,15,16)
InChIKeyLOHAFJZJRMKRPM-UHFFFAOYSA-N
MW265.34 g/mol
LogP1.62
Rot. Bonds5

About 2-N-(2-methoxy-1-thiophen-2-ylethyl)-6-methyl-1,3,5-triazine-2,4-diamine

2-N-(2-methoxy-1-thiophen-2-ylethyl)-6-methyl-1,3,5-triazine-2,4-diamine (PubChem CID 59874344) has the molecular formula C11H15N5OS and a molecular weight of 265.34 g/mol. Its IUPAC name is 2-N-(2-methoxy-1-thiophen-2-ylethyl)-6-methyl-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name2-N-(2-methoxy-1-thiophen-2-ylethyl)-6-methyl-1,3,5-triazine-2,4-diamine
PubChem CID59874344
Molecular FormulaC11H15N5OS
Molecular Weight265.34 g/mol
Exact Mass265.10
IUPAC Name2-N-(2-methoxy-1-thiophen-2-ylethyl)-6-methyl-1,3,5-triazine-2,4-diamine
SMILESCOCC(Nc1nc(C)nc(N)n1)c1cccs1
InChIInChI=1S/C11H15N5OS/c1-7-13-10(12)16-11(14-7)15-8(6-17-2)9-4-3-5-18-9/h3-5,8H,6H2,1-2H3,(H3,12,13,14,15,16)
InChIKeyLOHAFJZJRMKRPM-UHFFFAOYSA-N
XLogP1.62
TPSA85.95 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.34
LogP ≤ 51.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 2-N-(2-methoxy-1-thiophen-2-ylethyl)-6-methyl-1,3,5-triazine-2,4-diamine with MolForge

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Launch Full Analysis

Related Compounds

6-methyl-2-N-(1-thiophen-2-yloxybutan-2-yl)-1,3,5-triazine-2,4-diamine
CID 21348568
2-N,2-N-dimethyl-4-N-(1-thiophen-2-ylpropyl)-1,3,5-triazine-2,4,6-triamine
CID 80807202
6-(2-fluoropropan-2-yl)-2-N-(1-thiophen-2-ylpropyl)-1,3,5-triazine-2,4-diamine
CID 10859400
6-(1,2,2,2-tetrafluoroethyl)-2-N-(1-thiophen-2-ylpropyl)-1,3,5-triazine-2,4-diamine
CID 59874342
2-N,6-dimethyl-2-N-(1-thiophen-2-ylethyl)-1,3,5-triazine-2,4-diamine
CID 112746053
6-ethoxy-2-N-(1-thiophen-2-ylethyl)-1,3,5-triazine-2,4-diamine
CID 80780976
2-methoxy-1-thiophen-2-ylethanamine
CID 58736274
2,5-dimethyl-4-N-(1-thiophen-2-ylbutyl)pyrimidine-4,6-diamine
CID 80808300
4-hydrazinyl-6-methoxy-N-(1-thiophen-2-ylbutyl)-1,3,5-triazin-2-amine
CID 80897742
6-hydrazinyl-2,5-dimethyl-N-(1-thiophen-2-ylpropyl)pyrimidin-4-amine
CID 80896820
6-methoxy-2-N-(thiophen-2-ylmethyl)-1,3,5-triazine-2,4-diamine
CID 80773315
4-methyl-6-propoxy-N-(1-thiophen-2-ylbutyl)pyrimidin-2-amine
CID 115974776

Frequently Asked Questions

What is the IUPAC name of 2-N-(2-methoxy-1-thiophen-2-ylethyl)-6-methyl-1,3,5-triazine-2,4-diamine?
The IUPAC name of 2-N-(2-methoxy-1-thiophen-2-ylethyl)-6-methyl-1,3,5-triazine-2,4-diamine (CID 59874344) is 2-N-(2-methoxy-1-thiophen-2-ylethyl)-6-methyl-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 2-N-(2-methoxy-1-thiophen-2-ylethyl)-6-methyl-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 2-N-(2-methoxy-1-thiophen-2-ylethyl)-6-methyl-1,3,5-triazine-2,4-diamine is COCC(Nc1nc(C)nc(N)n1)c1cccs1.
What is the InChIKey of 2-N-(2-methoxy-1-thiophen-2-ylethyl)-6-methyl-1,3,5-triazine-2,4-diamine?
The InChIKey is LOHAFJZJRMKRPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5OS/c1-7-13-10(12)16-11(14-7)15-8(6-17-2)9-4-3-5-18-9/h3-5,8H,6H2,1-2H3,(H3,12,13,14,15,16).
What are the key properties of 2-N-(2-methoxy-1-thiophen-2-ylethyl)-6-methyl-1,3,5-triazine-2,4-diamine?
2-N-(2-methoxy-1-thiophen-2-ylethyl)-6-methyl-1,3,5-triazine-2,4-diamine has a molecular weight of 265.34 g/mol, XLogP of 1.62, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(2-methoxy-1-thiophen-2-ylethyl)-6-methyl-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 59874344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).