2-hydroxy-2-methyl-N-[(1-methylsulfanylcyclopropyl)methyl]propanamide

C9H17NO2S — CID 107299483

IUPAC2-hydroxy-2-methyl-N-[(1-methylsulfanylcyclopropyl)methyl]propanamide
SMILESCSC1(CNC(=O)C(C)(C)O)CC1
InChIInChI=1S/C9H17NO2S/c1-8(2,12)7(11)10-6-9(13-3)4-5-9/h12H,4-6H2,1-3H3,(H,10,11)
InChIKeyKFHDWYDLDXZUTE-UHFFFAOYSA-N
MW203.31 g/mol
LogP0.77
Rot. Bonds4

About 2-hydroxy-2-methyl-N-[(1-methylsulfanylcyclopropyl)methyl]propanamide

2-hydroxy-2-methyl-N-[(1-methylsulfanylcyclopropyl)methyl]propanamide (PubChem CID 107299483) has the molecular formula C9H17NO2S and a molecular weight of 203.31 g/mol. Its IUPAC name is 2-hydroxy-2-methyl-N-[(1-methylsulfanylcyclopropyl)methyl]propanamide.

Molecular Properties

Compound Name2-hydroxy-2-methyl-N-[(1-methylsulfanylcyclopropyl)methyl]propanamide
PubChem CID107299483
Molecular FormulaC9H17NO2S
Molecular Weight203.31 g/mol
Exact Mass203.10
IUPAC Name2-hydroxy-2-methyl-N-[(1-methylsulfanylcyclopropyl)methyl]propanamide
SMILESCSC1(CNC(=O)C(C)(C)O)CC1
InChIInChI=1S/C9H17NO2S/c1-8(2,12)7(11)10-6-9(13-3)4-5-9/h12H,4-6H2,1-3H3,(H,10,11)
InChIKeyKFHDWYDLDXZUTE-UHFFFAOYSA-N
XLogP0.77
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.31
LogP ≤ 50.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-cyano-2-methyl-N-[(1-methylsulfanylcyclopropyl)methyl]propanamide
CID 107299434
2-hydroxy-2-methyl-N-[(1-methylcyclobutyl)methyl]propanamide
CID 106509809
1-tert-butyl-3-[(1-methylsulfanylcyclobutyl)methyl]urea
CID 107265865
N-[(1-ethylcyclobutyl)methyl]-2-hydroxy-2-methylpropanamide
CID 106509811
2-(tert-butylamino)-N-[(1-methylsulfanylcyclopentyl)methyl]acetamide
CID 114116154
2-(tert-butylamino)-N-[(1-methylsulfanylcyclohexyl)methyl]acetamide
CID 114116225
1-(2-tert-butylpyrimidin-5-yl)-3-[(1-methylsulfanylcyclopropyl)methyl]urea
CID 119050388
N-[(1-methylsulfanylcyclopropyl)methyl]-2-propoxyacetamide
CID 107299396
ethyl N-[(1-methylsulfanylcyclobutyl)methyl]carbamate
CID 107299283
1-[(1-methylsulfanylcyclopropyl)methylcarbamoylamino]cyclohexane-1-carboxylic acid
CID 114116883
1-[(1-methylsulfanylcyclopentyl)methylcarbamoyl]cyclobutane-1-carboxylic acid
CID 114117430
1,1-diethyl-3-[(1-methylsulfanylcyclohexyl)methyl]urea
CID 114115882

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-2-methyl-N-[(1-methylsulfanylcyclopropyl)methyl]propanamide?
The IUPAC name of 2-hydroxy-2-methyl-N-[(1-methylsulfanylcyclopropyl)methyl]propanamide (CID 107299483) is 2-hydroxy-2-methyl-N-[(1-methylsulfanylcyclopropyl)methyl]propanamide.
What is the SMILES notation for 2-hydroxy-2-methyl-N-[(1-methylsulfanylcyclopropyl)methyl]propanamide?
The canonical SMILES for 2-hydroxy-2-methyl-N-[(1-methylsulfanylcyclopropyl)methyl]propanamide is CSC1(CNC(=O)C(C)(C)O)CC1.
What is the InChIKey of 2-hydroxy-2-methyl-N-[(1-methylsulfanylcyclopropyl)methyl]propanamide?
The InChIKey is KFHDWYDLDXZUTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO2S/c1-8(2,12)7(11)10-6-9(13-3)4-5-9/h12H,4-6H2,1-3H3,(H,10,11).
What are the key properties of 2-hydroxy-2-methyl-N-[(1-methylsulfanylcyclopropyl)methyl]propanamide?
2-hydroxy-2-methyl-N-[(1-methylsulfanylcyclopropyl)methyl]propanamide has a molecular weight of 203.31 g/mol, XLogP of 0.77, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-2-methyl-N-[(1-methylsulfanylcyclopropyl)methyl]propanamide is sourced from PubChem (CID 107299483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).