(2R)-2-amino-N-cyclopropylsulfonyl-2-ethylpentanamide

C10H20N2O3S — CID 70896758

IUPAC(2R)-2-amino-N-cyclopropylsulfonyl-2-ethylpentanamide
SMILESCCC[C@](N)(CC)C(=O)NS(=O)(=O)C1CC1
InChIInChI=1S/C10H20N2O3S/c1-3-7-10(11,4-2)9(13)12-16(14,15)8-5-6-8/h8H,3-7,11H2,1-2H3,(H,12,13)/t10-/m1/s1
InChIKeyXMBFIZBLSKAVKW-SNVBAGLBSA-N
MW248.35 g/mol
LogP0.50
Rot. Bonds6

About (2R)-2-amino-N-cyclopropylsulfonyl-2-ethylpentanamide

(2R)-2-amino-N-cyclopropylsulfonyl-2-ethylpentanamide (PubChem CID 70896758) has the molecular formula C10H20N2O3S and a molecular weight of 248.35 g/mol. Its IUPAC name is (2R)-2-amino-N-cyclopropylsulfonyl-2-ethylpentanamide.

Molecular Properties

Compound Name(2R)-2-amino-N-cyclopropylsulfonyl-2-ethylpentanamide
PubChem CID70896758
Molecular FormulaC10H20N2O3S
Molecular Weight248.35 g/mol
Exact Mass248.12
IUPAC Name(2R)-2-amino-N-cyclopropylsulfonyl-2-ethylpentanamide
SMILESCCC[C@](N)(CC)C(=O)NS(=O)(=O)C1CC1
InChIInChI=1S/C10H20N2O3S/c1-3-7-10(11,4-2)9(13)12-16(14,15)8-5-6-8/h8H,3-7,11H2,1-2H3,(H,12,13)/t10-/m1/s1
InChIKeyXMBFIZBLSKAVKW-SNVBAGLBSA-N
XLogP0.50
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.35
LogP ≤ 50.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-cyclopropylsulfonyl-2-ethylpentanamide?
The IUPAC name of (2R)-2-amino-N-cyclopropylsulfonyl-2-ethylpentanamide (CID 70896758) is (2R)-2-amino-N-cyclopropylsulfonyl-2-ethylpentanamide.
What is the SMILES notation for (2R)-2-amino-N-cyclopropylsulfonyl-2-ethylpentanamide?
The canonical SMILES for (2R)-2-amino-N-cyclopropylsulfonyl-2-ethylpentanamide is CCC[C@](N)(CC)C(=O)NS(=O)(=O)C1CC1.
What is the InChIKey of (2R)-2-amino-N-cyclopropylsulfonyl-2-ethylpentanamide?
The InChIKey is XMBFIZBLSKAVKW-SNVBAGLBSA-N. The full InChI is InChI=1S/C10H20N2O3S/c1-3-7-10(11,4-2)9(13)12-16(14,15)8-5-6-8/h8H,3-7,11H2,1-2H3,(H,12,13)/t10-/m1/s1.
What are the key properties of (2R)-2-amino-N-cyclopropylsulfonyl-2-ethylpentanamide?
(2R)-2-amino-N-cyclopropylsulfonyl-2-ethylpentanamide has a molecular weight of 248.35 g/mol, XLogP of 0.50, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-cyclopropylsulfonyl-2-ethylpentanamide is sourced from PubChem (CID 70896758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).