4-methyl-5-(3-propyl-1,2,4-oxadiazol-5-yl)thiophen-2-amine

C10H13N3OS — CID 43670391

IUPAC4-methyl-5-(3-propyl-1,2,4-oxadiazol-5-yl)thiophen-2-amine
SMILESCCCc1noc(-c2sc(N)cc2C)n1
InChIInChI=1S/C10H13N3OS/c1-3-4-8-12-10(14-13-8)9-6(2)5-7(11)15-9/h5H,3-4,11H2,1-2H3
InChIKeyHTZGJCGMONTEPU-UHFFFAOYSA-N
MW223.30 g/mol
LogP2.64
Rot. Bonds3

About 4-methyl-5-(3-propyl-1,2,4-oxadiazol-5-yl)thiophen-2-amine

4-methyl-5-(3-propyl-1,2,4-oxadiazol-5-yl)thiophen-2-amine (PubChem CID 43670391) has the molecular formula C10H13N3OS and a molecular weight of 223.30 g/mol. Its IUPAC name is 4-methyl-5-(3-propyl-1,2,4-oxadiazol-5-yl)thiophen-2-amine.

Molecular Properties

Compound Name4-methyl-5-(3-propyl-1,2,4-oxadiazol-5-yl)thiophen-2-amine
PubChem CID43670391
Molecular FormulaC10H13N3OS
Molecular Weight223.30 g/mol
Exact Mass223.08
IUPAC Name4-methyl-5-(3-propyl-1,2,4-oxadiazol-5-yl)thiophen-2-amine
SMILESCCCc1noc(-c2sc(N)cc2C)n1
InChIInChI=1S/C10H13N3OS/c1-3-4-8-12-10(14-13-8)9-6(2)5-7(11)15-9/h5H,3-4,11H2,1-2H3
InChIKeyHTZGJCGMONTEPU-UHFFFAOYSA-N
XLogP2.64
TPSA64.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.30
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-(5-amino-3-methylthiophen-2-yl)-N-ethyl-N-methyl-1,2,4-oxadiazol-3-amine
CID 116808203
4-methyl-5-[3-[(2-methyl-1,3-thiazol-4-yl)methyl]-1,2,4-oxadiazol-5-yl]thiophen-2-amine
CID 62798415
5-[3-(4-ethylcyclohexyl)-1,2,4-oxadiazol-5-yl]-4-methylthiophen-2-amine
CID 65395546
5-(3-cyclohexyl-1,2,4-oxadiazol-5-yl)-4-methylthiophen-2-amine
CID 43100925
5-[3-(4-ethoxyoxan-4-yl)-1,2,4-oxadiazol-5-yl]-4-methylthiophen-2-amine
CID 116742262
5-[3-(4-fluoro-3-methylphenyl)-1,2,4-oxadiazol-5-yl]-4-methylthiophen-2-amine
CID 60929614
5-[3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]-4-methylthiophen-2-amine
CID 43150811
4-methoxy-2-(3-propyl-1,2,4-oxadiazol-5-yl)aniline
CID 115411779
5-(3-ethyl-1,2,4-oxadiazol-5-yl)-4-methyl-1,3-thiazol-2-amine
CID 30029519
5-(5-methyl-1H-pyrazol-3-yl)-3-propyl-1,2,4-oxadiazole
CID 94069253
3-chloro-4-(3-propyl-1,2,4-oxadiazol-5-yl)aniline
CID 61398974
ethane;3-propyl-1,2,4-oxadiazol-5-amine
CID 153346311

Frequently Asked Questions

What is the IUPAC name of 4-methyl-5-(3-propyl-1,2,4-oxadiazol-5-yl)thiophen-2-amine?
The IUPAC name of 4-methyl-5-(3-propyl-1,2,4-oxadiazol-5-yl)thiophen-2-amine (CID 43670391) is 4-methyl-5-(3-propyl-1,2,4-oxadiazol-5-yl)thiophen-2-amine.
What is the SMILES notation for 4-methyl-5-(3-propyl-1,2,4-oxadiazol-5-yl)thiophen-2-amine?
The canonical SMILES for 4-methyl-5-(3-propyl-1,2,4-oxadiazol-5-yl)thiophen-2-amine is CCCc1noc(-c2sc(N)cc2C)n1.
What is the InChIKey of 4-methyl-5-(3-propyl-1,2,4-oxadiazol-5-yl)thiophen-2-amine?
The InChIKey is HTZGJCGMONTEPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3OS/c1-3-4-8-12-10(14-13-8)9-6(2)5-7(11)15-9/h5H,3-4,11H2,1-2H3.
What are the key properties of 4-methyl-5-(3-propyl-1,2,4-oxadiazol-5-yl)thiophen-2-amine?
4-methyl-5-(3-propyl-1,2,4-oxadiazol-5-yl)thiophen-2-amine has a molecular weight of 223.30 g/mol, XLogP of 2.64, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-5-(3-propyl-1,2,4-oxadiazol-5-yl)thiophen-2-amine is sourced from PubChem (CID 43670391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).