2-N-(2-methyl-2-thiophen-2-ylpropyl)-1,3,4-oxadiazole-2,5-diamine

C10H14N4OS — CID 103437186

IUPAC2-N-(2-methyl-2-thiophen-2-ylpropyl)-1,3,4-oxadiazole-2,5-diamine
SMILESCC(C)(CNc1nnc(N)o1)c1cccs1
InChIInChI=1S/C10H14N4OS/c1-10(2,7-4-3-5-16-7)6-12-9-14-13-8(11)15-9/h3-5H,6H2,1-2H3,(H2,11,13)(H,12,14)
InChIKeyWDZJYVXMDXCJDI-UHFFFAOYSA-N
MW238.32 g/mol
LogP2.10
Rot. Bonds4

About 2-N-(2-methyl-2-thiophen-2-ylpropyl)-1,3,4-oxadiazole-2,5-diamine

2-N-(2-methyl-2-thiophen-2-ylpropyl)-1,3,4-oxadiazole-2,5-diamine (PubChem CID 103437186) has the molecular formula C10H14N4OS and a molecular weight of 238.32 g/mol. Its IUPAC name is 2-N-(2-methyl-2-thiophen-2-ylpropyl)-1,3,4-oxadiazole-2,5-diamine.

Molecular Properties

Compound Name2-N-(2-methyl-2-thiophen-2-ylpropyl)-1,3,4-oxadiazole-2,5-diamine
PubChem CID103437186
Molecular FormulaC10H14N4OS
Molecular Weight238.32 g/mol
Exact Mass238.09
IUPAC Name2-N-(2-methyl-2-thiophen-2-ylpropyl)-1,3,4-oxadiazole-2,5-diamine
SMILESCC(C)(CNc1nnc(N)o1)c1cccs1
InChIInChI=1S/C10H14N4OS/c1-10(2,7-4-3-5-16-7)6-12-9-14-13-8(11)15-9/h3-5H,6H2,1-2H3,(H2,11,13)(H,12,14)
InChIKeyWDZJYVXMDXCJDI-UHFFFAOYSA-N
XLogP2.10
TPSA76.97 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.32
LogP ≤ 52.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

5-[(cyclopropylamino)methyl]-N-(2-methyl-2-thiophen-2-ylpropyl)-1,3,4-oxadiazol-2-amine
CID 106963241
2-N-(2-methyl-2-thiophen-2-ylpropyl)-1,3-benzoxazole-2,5-diamine
CID 80525948
5-N-(2-methyl-2-thiophen-2-ylpropyl)pyridine-2,5-diamine
CID 80525997
2-[(2-methyl-2-thiophen-2-ylpropyl)amino]pyridine-3-carboxamide
CID 78962887
3-N-(2-methyl-2-thiophen-2-ylpropyl)-1H-1,2,4-triazole-3,5-diamine
CID 80527787
4-N-(2-methyl-2-thiophen-2-ylpropyl)-5-propan-2-ylpyrimidine-4,6-diamine
CID 80851821
3-methyl-N-(2-methyl-2-thiophen-2-ylpropyl)pyridin-2-amine
CID 80528214
6-chloro-4-N-(2-methyl-2-thiophen-2-ylpropyl)pyrimidine-4,5-diamine
CID 80527084
2-methyl-2-thiophen-2-ylpropan-1-amine
CID 51664087
5-chloro-4-N-(2-methyl-2-thiophen-2-ylpropyl)pyrimidine-2,4-diamine
CID 80851975
N-(2-methyl-2-thiophen-2-ylpropyl)-1-phenyltetrazol-5-amine
CID 78963065
3-bromo-2-N-(2-methyl-2-thiophen-2-ylpropyl)pyridine-2,5-diamine
CID 80525947

Frequently Asked Questions

What is the IUPAC name of 2-N-(2-methyl-2-thiophen-2-ylpropyl)-1,3,4-oxadiazole-2,5-diamine?
The IUPAC name of 2-N-(2-methyl-2-thiophen-2-ylpropyl)-1,3,4-oxadiazole-2,5-diamine (CID 103437186) is 2-N-(2-methyl-2-thiophen-2-ylpropyl)-1,3,4-oxadiazole-2,5-diamine.
What is the SMILES notation for 2-N-(2-methyl-2-thiophen-2-ylpropyl)-1,3,4-oxadiazole-2,5-diamine?
The canonical SMILES for 2-N-(2-methyl-2-thiophen-2-ylpropyl)-1,3,4-oxadiazole-2,5-diamine is CC(C)(CNc1nnc(N)o1)c1cccs1.
What is the InChIKey of 2-N-(2-methyl-2-thiophen-2-ylpropyl)-1,3,4-oxadiazole-2,5-diamine?
The InChIKey is WDZJYVXMDXCJDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4OS/c1-10(2,7-4-3-5-16-7)6-12-9-14-13-8(11)15-9/h3-5H,6H2,1-2H3,(H2,11,13)(H,12,14).
What are the key properties of 2-N-(2-methyl-2-thiophen-2-ylpropyl)-1,3,4-oxadiazole-2,5-diamine?
2-N-(2-methyl-2-thiophen-2-ylpropyl)-1,3,4-oxadiazole-2,5-diamine has a molecular weight of 238.32 g/mol, XLogP of 2.10, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(2-methyl-2-thiophen-2-ylpropyl)-1,3,4-oxadiazole-2,5-diamine is sourced from PubChem (CID 103437186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).