ethane;5-methylthiophene-2,4-diamine

C7H14N2S — CID 144716042

IUPACethane;5-methylthiophene-2,4-diamine
SMILESCC.Cc1sc(N)cc1N
InChIInChI=1S/C5H8N2S.C2H6/c1-3-4(6)2-5(7)8-3;1-2/h2H,6-7H2,1H3;1-2H3
InChIKeyBYBPKZVUVWIVBU-UHFFFAOYSA-N
MW158.27 g/mol
LogP2.25
Rot. Bonds

About ethane;5-methylthiophene-2,4-diamine

ethane;5-methylthiophene-2,4-diamine (PubChem CID 144716042) has the molecular formula C7H14N2S and a molecular weight of 158.27 g/mol. Its IUPAC name is ethane;5-methylthiophene-2,4-diamine.

Molecular Properties

Compound Nameethane;5-methylthiophene-2,4-diamine
PubChem CID144716042
Molecular FormulaC7H14N2S
Molecular Weight158.27 g/mol
Exact Mass158.09
IUPAC Nameethane;5-methylthiophene-2,4-diamine
SMILESCC.Cc1sc(N)cc1N
InChIInChI=1S/C5H8N2S.C2H6/c1-3-4(6)2-5(7)8-3;1-2/h2H,6-7H2,1H3;1-2H3
InChIKeyBYBPKZVUVWIVBU-UHFFFAOYSA-N
XLogP2.25
TPSA52.04 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.27
LogP ≤ 52.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-ethyl-2-methylthiophen-3-amine
CID 123752198
4-[(1Z)-buta-1,3-dienyl]-5-methylthiophen-2-amine
CID 138552173
ethyl 4-amino-5-methylthiophene-2-carboxylate
CID 61310193
5-methyl-4-thiophen-2-ylthiophen-2-amine
CID 82399962
4-(4-fluoro-3-methylphenyl)-5-methylthiophen-2-amine
CID 82472828
4-[(2-chlorophenyl)methyl]-5-methylthiophen-2-amine
CID 98771509
2-hydroxyethyl 4-amino-5-methylthiophene-2-carboxylate
CID 61316008
4,7-dimethyl-1-benzothiophen-2-amine
CID 131095149
3,3-dimethylbutyl 4-amino-5-methylthiophene-2-carboxylate
CID 61481561
4-amino-N-(1,3-dihydroxypropan-2-yl)-5-methylthiophene-2-carboxamide
CID 65310256
5-methyl-4-(1-methylindol-3-yl)thiophen-2-amine
CID 82477886
cyanomethyl 4-amino-5-methylthiophene-2-carboxylate
CID 61316963

Frequently Asked Questions

What is the IUPAC name of ethane;5-methylthiophene-2,4-diamine?
The IUPAC name of ethane;5-methylthiophene-2,4-diamine (CID 144716042) is ethane;5-methylthiophene-2,4-diamine.
What is the SMILES notation for ethane;5-methylthiophene-2,4-diamine?
The canonical SMILES for ethane;5-methylthiophene-2,4-diamine is CC.Cc1sc(N)cc1N.
What is the InChIKey of ethane;5-methylthiophene-2,4-diamine?
The InChIKey is BYBPKZVUVWIVBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8N2S.C2H6/c1-3-4(6)2-5(7)8-3;1-2/h2H,6-7H2,1H3;1-2H3.
What are the key properties of ethane;5-methylthiophene-2,4-diamine?
ethane;5-methylthiophene-2,4-diamine has a molecular weight of 158.27 g/mol, XLogP of 2.25, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;5-methylthiophene-2,4-diamine is sourced from PubChem (CID 144716042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).