N-[2-(methanesulfonamido)-2-methylpropyl]-2-methoxyacetamide

C8H18N2O4S — CID 63902886

IUPACN-[2-(methanesulfonamido)-2-methylpropyl]-2-methoxyacetamide
SMILESCOCC(=O)NCC(C)(C)NS(C)(=O)=O
InChIInChI=1S/C8H18N2O4S/c1-8(2,10-15(4,12)13)6-9-7(11)5-14-3/h10H,5-6H2,1-4H3,(H,9,11)
InChIKeyKTRVTJQQPMKZGH-UHFFFAOYSA-N
MW238.31 g/mol
LogP-0.92
Rot. Bonds6

About N-[2-(methanesulfonamido)-2-methylpropyl]-2-methoxyacetamide

N-[2-(methanesulfonamido)-2-methylpropyl]-2-methoxyacetamide (PubChem CID 63902886) has the molecular formula C8H18N2O4S and a molecular weight of 238.31 g/mol. Its IUPAC name is N-[2-(methanesulfonamido)-2-methylpropyl]-2-methoxyacetamide.

Molecular Properties

Compound NameN-[2-(methanesulfonamido)-2-methylpropyl]-2-methoxyacetamide
PubChem CID63902886
Molecular FormulaC8H18N2O4S
Molecular Weight238.31 g/mol
Exact Mass238.10
IUPAC NameN-[2-(methanesulfonamido)-2-methylpropyl]-2-methoxyacetamide
SMILESCOCC(=O)NCC(C)(C)NS(C)(=O)=O
InChIInChI=1S/C8H18N2O4S/c1-8(2,10-15(4,12)13)6-9-7(11)5-14-3/h10H,5-6H2,1-4H3,(H,9,11)
InChIKeyKTRVTJQQPMKZGH-UHFFFAOYSA-N
XLogP-0.92
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.31
LogP ≤ 5-0.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(methanesulfonamido)-2-methylpropyl]-2-(propan-2-ylamino)acetamide
CID 63865581
6-amino-N-[2-(methanesulfonamido)-2-methylpropyl]hexanamide
CID 63865751
N-[2-(methanesulfonamido)ethyl]-2-methoxyacetamide
CID 60729923
1-[2-(methanesulfonamido)-2-methylpropyl]-3-(2-methoxyethyl)-2-methylguanidine
CID 111779047
N-[2-(methanesulfonamido)-2-methylpropyl]-2-sulfanylpropanamide
CID 107030203
(2S)-2-amino-N-[2-(methanesulfonamido)-2-methylpropyl]propanamide
CID 78952829
1-[2-[[2-(methanesulfonamido)-2-methylpropyl]amino]-2-oxoethyl]cyclopentane-1-carboxylic acid
CID 63861747
3-chloro-N-[[2-(methanesulfonamido)-2-methylpropyl]carbamoyl]propanamide
CID 63860131
methyl 2-hydroxy-3-[[2-(methanesulfonamido)-2-methylpropyl]amino]-2-methylpropanoate
CID 113436539
methyl 3-[[2-(methanesulfonamido)-2-methylpropyl]amino]propanoate
CID 63860915
(2S)-2-amino-N-[2-(methanesulfonamido)-2-methylpropyl]-3-methylbutanamide
CID 63865932
2-[carboxymethyl-[[2-(methanesulfonamido)-2-methylpropyl]carbamoyl]amino]acetic acid
CID 63858308

Frequently Asked Questions

What is the IUPAC name of N-[2-(methanesulfonamido)-2-methylpropyl]-2-methoxyacetamide?
The IUPAC name of N-[2-(methanesulfonamido)-2-methylpropyl]-2-methoxyacetamide (CID 63902886) is N-[2-(methanesulfonamido)-2-methylpropyl]-2-methoxyacetamide.
What is the SMILES notation for N-[2-(methanesulfonamido)-2-methylpropyl]-2-methoxyacetamide?
The canonical SMILES for N-[2-(methanesulfonamido)-2-methylpropyl]-2-methoxyacetamide is COCC(=O)NCC(C)(C)NS(C)(=O)=O.
What is the InChIKey of N-[2-(methanesulfonamido)-2-methylpropyl]-2-methoxyacetamide?
The InChIKey is KTRVTJQQPMKZGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2O4S/c1-8(2,10-15(4,12)13)6-9-7(11)5-14-3/h10H,5-6H2,1-4H3,(H,9,11).
What are the key properties of N-[2-(methanesulfonamido)-2-methylpropyl]-2-methoxyacetamide?
N-[2-(methanesulfonamido)-2-methylpropyl]-2-methoxyacetamide has a molecular weight of 238.31 g/mol, XLogP of -0.92, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(methanesulfonamido)-2-methylpropyl]-2-methoxyacetamide is sourced from PubChem (CID 63902886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).