2-methyl-2-(methylamino)-4-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]pentanamide

C10H18N4O2S — CID 64705307

IUPAC2-methyl-2-(methylamino)-4-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]pentanamide
SMILESCNC(C)(CC(C)Sc1nnc(C)o1)C(N)=O
InChIInChI=1S/C10H18N4O2S/c1-6(5-10(3,12-4)8(11)15)17-9-14-13-7(2)16-9/h6,12H,5H2,1-4H3,(H2,11,15)
InChIKeyULHGRRSQDFFDEM-UHFFFAOYSA-N
MW258.35 g/mol
LogP0.71
Rot. Bonds6

About 2-methyl-2-(methylamino)-4-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]pentanamide

2-methyl-2-(methylamino)-4-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]pentanamide (PubChem CID 64705307) has the molecular formula C10H18N4O2S and a molecular weight of 258.35 g/mol. Its IUPAC name is 2-methyl-2-(methylamino)-4-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]pentanamide.

Molecular Properties

Compound Name2-methyl-2-(methylamino)-4-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]pentanamide
PubChem CID64705307
Molecular FormulaC10H18N4O2S
Molecular Weight258.35 g/mol
Exact Mass258.12
IUPAC Name2-methyl-2-(methylamino)-4-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]pentanamide
SMILESCNC(C)(CC(C)Sc1nnc(C)o1)C(N)=O
InChIInChI=1S/C10H18N4O2S/c1-6(5-10(3,12-4)8(11)15)17-9-14-13-7(2)16-9/h6,12H,5H2,1-4H3,(H2,11,15)
InChIKeyULHGRRSQDFFDEM-UHFFFAOYSA-N
XLogP0.71
TPSA94.04 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.35
LogP ≤ 50.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-(methylamino)-4-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]pentanamide?
The IUPAC name of 2-methyl-2-(methylamino)-4-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]pentanamide (CID 64705307) is 2-methyl-2-(methylamino)-4-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]pentanamide.
What is the SMILES notation for 2-methyl-2-(methylamino)-4-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]pentanamide?
The canonical SMILES for 2-methyl-2-(methylamino)-4-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]pentanamide is CNC(C)(CC(C)Sc1nnc(C)o1)C(N)=O.
What is the InChIKey of 2-methyl-2-(methylamino)-4-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]pentanamide?
The InChIKey is ULHGRRSQDFFDEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O2S/c1-6(5-10(3,12-4)8(11)15)17-9-14-13-7(2)16-9/h6,12H,5H2,1-4H3,(H2,11,15).
What are the key properties of 2-methyl-2-(methylamino)-4-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]pentanamide?
2-methyl-2-(methylamino)-4-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]pentanamide has a molecular weight of 258.35 g/mol, XLogP of 0.71, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-(methylamino)-4-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]pentanamide is sourced from PubChem (CID 64705307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).