2-amino-2-cyclopropyl-N-(2-methylsulfinylethyl)propanamide

C9H18N2O2S — CID 115746770

IUPAC2-amino-2-cyclopropyl-N-(2-methylsulfinylethyl)propanamide
SMILESCS(=O)CCNC(=O)C(C)(N)C1CC1
InChIInChI=1S/C9H18N2O2S/c1-9(10,7-3-4-7)8(12)11-5-6-14(2)13/h7H,3-6,10H2,1-2H3,(H,11,12)
InChIKeyHEIACNWAXWOYKY-UHFFFAOYSA-N
MW218.32 g/mol
LogP-0.39
Rot. Bonds5

About 2-amino-2-cyclopropyl-N-(2-methylsulfinylethyl)propanamide

2-amino-2-cyclopropyl-N-(2-methylsulfinylethyl)propanamide (PubChem CID 115746770) has the molecular formula C9H18N2O2S and a molecular weight of 218.32 g/mol. Its IUPAC name is 2-amino-2-cyclopropyl-N-(2-methylsulfinylethyl)propanamide.

Molecular Properties

Compound Name2-amino-2-cyclopropyl-N-(2-methylsulfinylethyl)propanamide
PubChem CID115746770
Molecular FormulaC9H18N2O2S
Molecular Weight218.32 g/mol
Exact Mass218.11
IUPAC Name2-amino-2-cyclopropyl-N-(2-methylsulfinylethyl)propanamide
SMILESCS(=O)CCNC(=O)C(C)(N)C1CC1
InChIInChI=1S/C9H18N2O2S/c1-9(10,7-3-4-7)8(12)11-5-6-14(2)13/h7H,3-6,10H2,1-2H3,(H,11,12)
InChIKeyHEIACNWAXWOYKY-UHFFFAOYSA-N
XLogP-0.39
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.32
LogP ≤ 5-0.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-(2-cyclopentylethyl)-2-cyclopropylpropanamide
CID 60919572
4-[(2-amino-2-cyclopropylpropanoyl)amino]butanamide
CID 60865576
2-amino-2-cyclopropyl-N-[3-(dimethylamino)-3-oxopropyl]propanamide
CID 60926837
2-amino-2-cyclopropyl-N-(cyclopropylmethyl)propanamide
CID 60867867
2-amino-2-cyclopropyl-N-[2-(2-methylpropoxy)ethyl]propanamide
CID 115746731
2-amino-2-cyclopropyl-N-(2-ethylbutyl)propanamide
CID 115746720
2-amino-2-cyclopropyl-N-[2-(cyclopropylamino)-2-oxoethyl]propanamide
CID 60866101
2-amino-2-cyclopropyl-N-(2,2-dimethoxyethyl)propanamide
CID 61274918
2-amino-2-cyclopropyl-N-(2-methylbutyl)propanamide
CID 62694160
2-amino-2-cyclopropyl-N-(2-pyrazol-1-ylethyl)propanamide
CID 61461071
2-amino-2-cyclopropyl-N-(2-methylbutan-2-yl)propanamide
CID 60866770
2-amino-2-cyclopropyl-N-[(1-methylcyclopentyl)methyl]propanamide
CID 63831590

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-cyclopropyl-N-(2-methylsulfinylethyl)propanamide?
The IUPAC name of 2-amino-2-cyclopropyl-N-(2-methylsulfinylethyl)propanamide (CID 115746770) is 2-amino-2-cyclopropyl-N-(2-methylsulfinylethyl)propanamide.
What is the SMILES notation for 2-amino-2-cyclopropyl-N-(2-methylsulfinylethyl)propanamide?
The canonical SMILES for 2-amino-2-cyclopropyl-N-(2-methylsulfinylethyl)propanamide is CS(=O)CCNC(=O)C(C)(N)C1CC1.
What is the InChIKey of 2-amino-2-cyclopropyl-N-(2-methylsulfinylethyl)propanamide?
The InChIKey is HEIACNWAXWOYKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O2S/c1-9(10,7-3-4-7)8(12)11-5-6-14(2)13/h7H,3-6,10H2,1-2H3,(H,11,12).
What are the key properties of 2-amino-2-cyclopropyl-N-(2-methylsulfinylethyl)propanamide?
2-amino-2-cyclopropyl-N-(2-methylsulfinylethyl)propanamide has a molecular weight of 218.32 g/mol, XLogP of -0.39, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-cyclopropyl-N-(2-methylsulfinylethyl)propanamide is sourced from PubChem (CID 115746770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).