N-(1-amino-2-methylbutan-2-yl)-N-ethylpropane-2-sulfonamide

C10H24N2O2S — CID 62008248

IUPACN-(1-amino-2-methylbutan-2-yl)-N-ethylpropane-2-sulfonamide
SMILESCCN(C(C)(CC)CN)S(=O)(=O)C(C)C
InChIInChI=1S/C10H24N2O2S/c1-6-10(5,8-11)12(7-2)15(13,14)9(3)4/h9H,6-8,11H2,1-5H3
InChIKeyNORKGRKDVMEPEQ-UHFFFAOYSA-N
MW236.38 g/mol
LogP1.17
Rot. Bonds6

About N-(1-amino-2-methylbutan-2-yl)-N-ethylpropane-2-sulfonamide

N-(1-amino-2-methylbutan-2-yl)-N-ethylpropane-2-sulfonamide (PubChem CID 62008248) has the molecular formula C10H24N2O2S and a molecular weight of 236.38 g/mol. Its IUPAC name is N-(1-amino-2-methylbutan-2-yl)-N-ethylpropane-2-sulfonamide.

Molecular Properties

Compound NameN-(1-amino-2-methylbutan-2-yl)-N-ethylpropane-2-sulfonamide
PubChem CID62008248
Molecular FormulaC10H24N2O2S
Molecular Weight236.38 g/mol
Exact Mass236.16
IUPAC NameN-(1-amino-2-methylbutan-2-yl)-N-ethylpropane-2-sulfonamide
SMILESCCN(C(C)(CC)CN)S(=O)(=O)C(C)C
InChIInChI=1S/C10H24N2O2S/c1-6-10(5,8-11)12(7-2)15(13,14)9(3)4/h9H,6-8,11H2,1-5H3
InChIKeyNORKGRKDVMEPEQ-UHFFFAOYSA-N
XLogP1.17
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.38
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1-amino-2-methylbutan-2-yl)-N-ethylpropane-2-sulfonamide?
The IUPAC name of N-(1-amino-2-methylbutan-2-yl)-N-ethylpropane-2-sulfonamide (CID 62008248) is N-(1-amino-2-methylbutan-2-yl)-N-ethylpropane-2-sulfonamide.
What is the SMILES notation for N-(1-amino-2-methylbutan-2-yl)-N-ethylpropane-2-sulfonamide?
The canonical SMILES for N-(1-amino-2-methylbutan-2-yl)-N-ethylpropane-2-sulfonamide is CCN(C(C)(CC)CN)S(=O)(=O)C(C)C.
What is the InChIKey of N-(1-amino-2-methylbutan-2-yl)-N-ethylpropane-2-sulfonamide?
The InChIKey is NORKGRKDVMEPEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H24N2O2S/c1-6-10(5,8-11)12(7-2)15(13,14)9(3)4/h9H,6-8,11H2,1-5H3.
What are the key properties of N-(1-amino-2-methylbutan-2-yl)-N-ethylpropane-2-sulfonamide?
N-(1-amino-2-methylbutan-2-yl)-N-ethylpropane-2-sulfonamide has a molecular weight of 236.38 g/mol, XLogP of 1.17, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-amino-2-methylbutan-2-yl)-N-ethylpropane-2-sulfonamide is sourced from PubChem (CID 62008248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).