2-methyl-3-(oxetan-3-ylsulfanyl)-2-(propan-2-ylamino)propanamide

C10H20N2O2S — CID 79325666

IUPAC2-methyl-3-(oxetan-3-ylsulfanyl)-2-(propan-2-ylamino)propanamide
SMILESCC(C)NC(C)(CSC1COC1)C(N)=O
InChIInChI=1S/C10H20N2O2S/c1-7(2)12-10(3,9(11)13)6-15-8-4-14-5-8/h7-8,12H,4-6H2,1-3H3,(H2,11,13)
InChIKeyUYPACNVZGHQWOB-UHFFFAOYSA-N
MW232.35 g/mol
LogP0.36
Rot. Bonds6

About 2-methyl-3-(oxetan-3-ylsulfanyl)-2-(propan-2-ylamino)propanamide

2-methyl-3-(oxetan-3-ylsulfanyl)-2-(propan-2-ylamino)propanamide (PubChem CID 79325666) has the molecular formula C10H20N2O2S and a molecular weight of 232.35 g/mol. Its IUPAC name is 2-methyl-3-(oxetan-3-ylsulfanyl)-2-(propan-2-ylamino)propanamide.

Molecular Properties

Compound Name2-methyl-3-(oxetan-3-ylsulfanyl)-2-(propan-2-ylamino)propanamide
PubChem CID79325666
Molecular FormulaC10H20N2O2S
Molecular Weight232.35 g/mol
Exact Mass232.12
IUPAC Name2-methyl-3-(oxetan-3-ylsulfanyl)-2-(propan-2-ylamino)propanamide
SMILESCC(C)NC(C)(CSC1COC1)C(N)=O
InChIInChI=1S/C10H20N2O2S/c1-7(2)12-10(3,9(11)13)6-15-8-4-14-5-8/h7-8,12H,4-6H2,1-3H3,(H2,11,13)
InChIKeyUYPACNVZGHQWOB-UHFFFAOYSA-N
XLogP0.36
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.35
LogP ≤ 50.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-methyl-3-(oxetan-3-ylsulfanyl)-2-(propan-2-ylamino)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-methyl-3-(oxan-4-ylsulfanyl)-2-(propan-2-ylamino)propanamide
CID 62991593
2-methyl-4-(oxetan-3-ylsulfanyl)-2-(propan-2-ylamino)butanoic acid
CID 79326686
2,2-dimethyl-3-(oxetan-3-ylsulfanyl)propanehydrazide
CID 79631577
2-amino-2-methyl-3-(oxetan-3-ylsulfanyl)propanoic acid
CID 79326790
2-(cyclopropylamino)-2-methyl-5-(oxetan-3-ylsulfanyl)pentanamide
CID 79326236
2-methyl-3-[2-oxo-2-(propan-2-ylamino)ethyl]sulfanyl-2-(propan-2-ylamino)propanamide
CID 114234454
3-cyclopentylsulfanyl-2-(ethylamino)-2-methylpropanamide
CID 63115926
2-methyl-3-(oxan-4-ylmethoxy)-2-(propan-2-ylamino)propanamide
CID 62382112
3-(3-methoxypropylsulfanyl)-2-methyl-2-(propan-2-ylamino)propanamide
CID 63855423
4-(2-cyclopropylethoxy)-2-methyl-2-(propan-2-ylamino)pentanamide
CID 114157820
4-ethoxy-2-methyl-2-(propan-2-ylamino)pentanamide
CID 64707210
2-methyl-3-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)-2-(propan-2-ylamino)propanamide
CID 79175461

Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-(oxetan-3-ylsulfanyl)-2-(propan-2-ylamino)propanamide?
The IUPAC name of 2-methyl-3-(oxetan-3-ylsulfanyl)-2-(propan-2-ylamino)propanamide (CID 79325666) is 2-methyl-3-(oxetan-3-ylsulfanyl)-2-(propan-2-ylamino)propanamide.
What is the SMILES notation for 2-methyl-3-(oxetan-3-ylsulfanyl)-2-(propan-2-ylamino)propanamide?
The canonical SMILES for 2-methyl-3-(oxetan-3-ylsulfanyl)-2-(propan-2-ylamino)propanamide is CC(C)NC(C)(CSC1COC1)C(N)=O.
What is the InChIKey of 2-methyl-3-(oxetan-3-ylsulfanyl)-2-(propan-2-ylamino)propanamide?
The InChIKey is UYPACNVZGHQWOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2S/c1-7(2)12-10(3,9(11)13)6-15-8-4-14-5-8/h7-8,12H,4-6H2,1-3H3,(H2,11,13).
What are the key properties of 2-methyl-3-(oxetan-3-ylsulfanyl)-2-(propan-2-ylamino)propanamide?
2-methyl-3-(oxetan-3-ylsulfanyl)-2-(propan-2-ylamino)propanamide has a molecular weight of 232.35 g/mol, XLogP of 0.36, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-(oxetan-3-ylsulfanyl)-2-(propan-2-ylamino)propanamide is sourced from PubChem (CID 79325666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).