2-amino-2-cyclopropyl-N-(1-methylsulfonylpropan-2-yl)propanamide

C10H20N2O3S — CID 64643013

IUPAC2-amino-2-cyclopropyl-N-(1-methylsulfonylpropan-2-yl)propanamide
SMILESCC(CS(C)(=O)=O)NC(=O)C(C)(N)C1CC1
InChIInChI=1S/C10H20N2O3S/c1-7(6-16(3,14)15)12-9(13)10(2,11)8-4-5-8/h7-8H,4-6,11H2,1-3H3,(H,12,13)
InChIKeyPDTBDSVTKVBDCT-UHFFFAOYSA-N
MW248.35 g/mol
LogP-0.34
Rot. Bonds5

About 2-amino-2-cyclopropyl-N-(1-methylsulfonylpropan-2-yl)propanamide

2-amino-2-cyclopropyl-N-(1-methylsulfonylpropan-2-yl)propanamide (PubChem CID 64643013) has the molecular formula C10H20N2O3S and a molecular weight of 248.35 g/mol. Its IUPAC name is 2-amino-2-cyclopropyl-N-(1-methylsulfonylpropan-2-yl)propanamide.

Molecular Properties

Compound Name2-amino-2-cyclopropyl-N-(1-methylsulfonylpropan-2-yl)propanamide
PubChem CID64643013
Molecular FormulaC10H20N2O3S
Molecular Weight248.35 g/mol
Exact Mass248.12
IUPAC Name2-amino-2-cyclopropyl-N-(1-methylsulfonylpropan-2-yl)propanamide
SMILESCC(CS(C)(=O)=O)NC(=O)C(C)(N)C1CC1
InChIInChI=1S/C10H20N2O3S/c1-7(6-16(3,14)15)12-9(13)10(2,11)8-4-5-8/h7-8H,4-6,11H2,1-3H3,(H,12,13)
InChIKeyPDTBDSVTKVBDCT-UHFFFAOYSA-N
XLogP-0.34
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.35
LogP ≤ 5-0.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-[(2-amino-2-cyclopropylpropanoyl)amino]butanamide
CID 115746838
2-amino-2-cyclopropyl-N-hexan-2-ylpropanamide
CID 62198947
2-amino-2-cyclopropyl-N-pent-4-yn-2-ylpropanamide
CID 115976498
2-cyclopropyl-2-(1-methylsulfonylpropan-2-ylcarbamoylamino)propanoic acid
CID 64643053
2-amino-2-cyclopropyl-N-(3-methylpentan-2-yl)propanamide
CID 61463878
2-amino-2-cyclopropyl-N-(3-ethylpentan-2-yl)propanamide
CID 63843687
3-chloro-2,2-dimethyl-N-(1-methylsulfonylpropan-2-yl)propanamide
CID 64630190
2-amino-2-cyclopropyl-N-[1-(diethylamino)-1-oxopropan-2-yl]propanamide
CID 60867535
2-amino-N-(1-methylsulfonylpropan-2-yl)-2-phenylpropanamide
CID 64642432
2-amino-2-cyclopropyl-N-(1-thiophen-2-ylpropan-2-yl)propanamide
CID 60866290
2-amino-2-cyclopropyl-N-[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]propanamide
CID 103109023
(2R)-2-amino-3,3-dimethyl-N-(1-methylsulfonylpropan-2-yl)butanamide
CID 103930040

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-cyclopropyl-N-(1-methylsulfonylpropan-2-yl)propanamide?
The IUPAC name of 2-amino-2-cyclopropyl-N-(1-methylsulfonylpropan-2-yl)propanamide (CID 64643013) is 2-amino-2-cyclopropyl-N-(1-methylsulfonylpropan-2-yl)propanamide.
What is the SMILES notation for 2-amino-2-cyclopropyl-N-(1-methylsulfonylpropan-2-yl)propanamide?
The canonical SMILES for 2-amino-2-cyclopropyl-N-(1-methylsulfonylpropan-2-yl)propanamide is CC(CS(C)(=O)=O)NC(=O)C(C)(N)C1CC1.
What is the InChIKey of 2-amino-2-cyclopropyl-N-(1-methylsulfonylpropan-2-yl)propanamide?
The InChIKey is PDTBDSVTKVBDCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O3S/c1-7(6-16(3,14)15)12-9(13)10(2,11)8-4-5-8/h7-8H,4-6,11H2,1-3H3,(H,12,13).
What are the key properties of 2-amino-2-cyclopropyl-N-(1-methylsulfonylpropan-2-yl)propanamide?
2-amino-2-cyclopropyl-N-(1-methylsulfonylpropan-2-yl)propanamide has a molecular weight of 248.35 g/mol, XLogP of -0.34, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-cyclopropyl-N-(1-methylsulfonylpropan-2-yl)propanamide is sourced from PubChem (CID 64643013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).