N,N-dimethyl-2-[methyl-[[3-(methylsulfanylmethyl)-1,2,4-oxadiazol-5-yl]methyl]amino]propanamide

C11H20N4O2S — CID 91843160

IUPACN,N-dimethyl-2-[methyl-[[3-(methylsulfanylmethyl)-1,2,4-oxadiazol-5-yl]methyl]amino]propanamide
SMILESCSCc1noc(CN(C)C(C)C(=O)N(C)C)n1
InChIInChI=1S/C11H20N4O2S/c1-8(11(16)14(2)3)15(4)6-10-12-9(7-18-5)13-17-10/h8H,6-7H2,1-5H3
InChIKeyRRYCSHNRFCNYHB-UHFFFAOYSA-N
MW272.37 g/mol
LogP0.84
Rot. Bonds6

About N,N-dimethyl-2-[methyl-[[3-(methylsulfanylmethyl)-1,2,4-oxadiazol-5-yl]methyl]amino]propanamide

N,N-dimethyl-2-[methyl-[[3-(methylsulfanylmethyl)-1,2,4-oxadiazol-5-yl]methyl]amino]propanamide (PubChem CID 91843160) has the molecular formula C11H20N4O2S and a molecular weight of 272.37 g/mol. Its IUPAC name is N,N-dimethyl-2-[methyl-[[3-(methylsulfanylmethyl)-1,2,4-oxadiazol-5-yl]methyl]amino]propanamide.

Molecular Properties

Compound NameN,N-dimethyl-2-[methyl-[[3-(methylsulfanylmethyl)-1,2,4-oxadiazol-5-yl]methyl]amino]propanamide
PubChem CID91843160
Molecular FormulaC11H20N4O2S
Molecular Weight272.37 g/mol
Exact Mass272.13
IUPAC NameN,N-dimethyl-2-[methyl-[[3-(methylsulfanylmethyl)-1,2,4-oxadiazol-5-yl]methyl]amino]propanamide
SMILESCSCc1noc(CN(C)C(C)C(=O)N(C)C)n1
InChIInChI=1S/C11H20N4O2S/c1-8(11(16)14(2)3)15(4)6-10-12-9(7-18-5)13-17-10/h8H,6-7H2,1-5H3
InChIKeyRRYCSHNRFCNYHB-UHFFFAOYSA-N
XLogP0.84
TPSA62.47 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.37
LogP ≤ 50.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze N,N-dimethyl-2-[methyl-[[3-(methylsulfanylmethyl)-1,2,4-oxadiazol-5-yl]methyl]amino]propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl-methylamino]propanoic acid
CID 62637255
3-[3-(methylsulfanylmethyl)-1,2,4-oxadiazol-5-yl]propanoic acid
CID 62691705
(2R)-3-[methyl-[[3-(methylsulfanylmethyl)-1,2,4-oxadiazol-5-yl]methyl]amino]propane-1,2-diol
CID 124755326
1-(5-ethyl-1,2,4-oxadiazol-3-yl)-N-methyl-N-[[3-(methylsulfanylmethyl)-1,2,4-oxadiazol-5-yl]methyl]methanamine
CID 91842487
2-[(3-benzyl-1,2,4-oxadiazol-5-yl)methyl-methylamino]propanoic acid;hydrochloride
CID 119912606
4-[3-(methylsulfanylmethyl)-1,2,4-oxadiazol-5-yl]butan-2-ol
CID 63346150
1,1-difluoro-3-[3-(methylsulfanylmethyl)-1,2,4-oxadiazol-5-yl]propan-2-one
CID 63344687
1-[3-(methylsulfanylmethyl)-1,2,4-oxadiazol-5-yl]propan-2-amine
CID 62694731
2-[methyl-[[5-(2-methylpropyl)-1,2,4-oxadiazol-3-yl]methyl]amino]propanoic acid
CID 62637246
1-(3,5-dimethyl-1,2-oxazol-4-yl)-N-methyl-N-[[3-(methylsulfanylmethyl)-1,2,4-oxadiazol-5-yl]methyl]methanamine
CID 91832326
(2S)-N-cyclopentyl-2-[methyl-[[3-(2-methylpropyl)-1,2,4-oxadiazol-5-yl]methyl]amino]propanamide
CID 95147928
2-[[3-[(3-bromophenyl)methyl]-1,2,4-oxadiazol-5-yl]methyl-methylamino]propanoic acid;hydrochloride
CID 119913158

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-[methyl-[[3-(methylsulfanylmethyl)-1,2,4-oxadiazol-5-yl]methyl]amino]propanamide?
The IUPAC name of N,N-dimethyl-2-[methyl-[[3-(methylsulfanylmethyl)-1,2,4-oxadiazol-5-yl]methyl]amino]propanamide (CID 91843160) is N,N-dimethyl-2-[methyl-[[3-(methylsulfanylmethyl)-1,2,4-oxadiazol-5-yl]methyl]amino]propanamide.
What is the SMILES notation for N,N-dimethyl-2-[methyl-[[3-(methylsulfanylmethyl)-1,2,4-oxadiazol-5-yl]methyl]amino]propanamide?
The canonical SMILES for N,N-dimethyl-2-[methyl-[[3-(methylsulfanylmethyl)-1,2,4-oxadiazol-5-yl]methyl]amino]propanamide is CSCc1noc(CN(C)C(C)C(=O)N(C)C)n1.
What is the InChIKey of N,N-dimethyl-2-[methyl-[[3-(methylsulfanylmethyl)-1,2,4-oxadiazol-5-yl]methyl]amino]propanamide?
The InChIKey is RRYCSHNRFCNYHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4O2S/c1-8(11(16)14(2)3)15(4)6-10-12-9(7-18-5)13-17-10/h8H,6-7H2,1-5H3.
What are the key properties of N,N-dimethyl-2-[methyl-[[3-(methylsulfanylmethyl)-1,2,4-oxadiazol-5-yl]methyl]amino]propanamide?
N,N-dimethyl-2-[methyl-[[3-(methylsulfanylmethyl)-1,2,4-oxadiazol-5-yl]methyl]amino]propanamide has a molecular weight of 272.37 g/mol, XLogP of 0.84, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-[methyl-[[3-(methylsulfanylmethyl)-1,2,4-oxadiazol-5-yl]methyl]amino]propanamide is sourced from PubChem (CID 91843160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).