N-(2-tert-butylsulfonylethyl)-1-methoxy-2-methylpropan-2-amine

C11H25NO3S — CID 103713921

IUPACN-(2-tert-butylsulfonylethyl)-1-methoxy-2-methylpropan-2-amine
SMILESCOCC(C)(C)NCCS(=O)(=O)C(C)(C)C
InChIInChI=1S/C11H25NO3S/c1-10(2,3)16(13,14)8-7-12-11(4,5)9-15-6/h12H,7-9H2,1-6H3
InChIKeyPKSHJLBMSKJRBD-UHFFFAOYSA-N
MW251.39 g/mol
LogP1.21
Rot. Bonds6

About N-(2-tert-butylsulfonylethyl)-1-methoxy-2-methylpropan-2-amine

N-(2-tert-butylsulfonylethyl)-1-methoxy-2-methylpropan-2-amine (PubChem CID 103713921) has the molecular formula C11H25NO3S and a molecular weight of 251.39 g/mol. Its IUPAC name is N-(2-tert-butylsulfonylethyl)-1-methoxy-2-methylpropan-2-amine.

Molecular Properties

Compound NameN-(2-tert-butylsulfonylethyl)-1-methoxy-2-methylpropan-2-amine
PubChem CID103713921
Molecular FormulaC11H25NO3S
Molecular Weight251.39 g/mol
Exact Mass251.16
IUPAC NameN-(2-tert-butylsulfonylethyl)-1-methoxy-2-methylpropan-2-amine
SMILESCOCC(C)(C)NCCS(=O)(=O)C(C)(C)C
InChIInChI=1S/C11H25NO3S/c1-10(2,3)16(13,14)8-7-12-11(4,5)9-15-6/h12H,7-9H2,1-6H3
InChIKeyPKSHJLBMSKJRBD-UHFFFAOYSA-N
XLogP1.21
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.39
LogP ≤ 51.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-methoxy-N-(2-methoxyethyl)-2-methylpropan-2-amine
CID 115609446
2-(methoxymethylsulfonyl)-2-methylpropane
CID 12629501
4-[(1-methoxy-2-methylpropan-2-yl)amino]-2-methylbutan-2-ol
CID 115679518
N-(1-methoxy-2-methylpropan-2-yl)hexan-1-amine
CID 115644983
1-methoxy-2-methyl-N-[2-[(2-methylpropan-2-yl)oxy]ethyl]propan-2-amine
CID 115609397
N-(2-tert-butylsulfonylethyl)-1-methoxybutan-2-amine
CID 115889765
2-(2-tert-butylsulfonylethylamino)-2-ethylpropane-1,3-diol
CID 107865483
ethane;N-ethyl-1-methoxy-2-methylpropan-2-amine
CID 177317291
N-(2-ethylsulfanylethyl)-1-methoxy-2-methylpropan-2-amine
CID 115648465
N-(1-methoxy-2-methylpropan-2-yl)ethanesulfonamide
CID 115617292
2-(2-tert-butylsulfonylethyl)-1,1-dimethylhydrazine
CID 106724235
1-N-(2-tert-butylsulfonylethyl)-2-N,2-N,2-trimethylpropane-1,2-diamine
CID 106723490

Frequently Asked Questions

What is the IUPAC name of N-(2-tert-butylsulfonylethyl)-1-methoxy-2-methylpropan-2-amine?
The IUPAC name of N-(2-tert-butylsulfonylethyl)-1-methoxy-2-methylpropan-2-amine (CID 103713921) is N-(2-tert-butylsulfonylethyl)-1-methoxy-2-methylpropan-2-amine.
What is the SMILES notation for N-(2-tert-butylsulfonylethyl)-1-methoxy-2-methylpropan-2-amine?
The canonical SMILES for N-(2-tert-butylsulfonylethyl)-1-methoxy-2-methylpropan-2-amine is COCC(C)(C)NCCS(=O)(=O)C(C)(C)C.
What is the InChIKey of N-(2-tert-butylsulfonylethyl)-1-methoxy-2-methylpropan-2-amine?
The InChIKey is PKSHJLBMSKJRBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25NO3S/c1-10(2,3)16(13,14)8-7-12-11(4,5)9-15-6/h12H,7-9H2,1-6H3.
What are the key properties of N-(2-tert-butylsulfonylethyl)-1-methoxy-2-methylpropan-2-amine?
N-(2-tert-butylsulfonylethyl)-1-methoxy-2-methylpropan-2-amine has a molecular weight of 251.39 g/mol, XLogP of 1.21, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-tert-butylsulfonylethyl)-1-methoxy-2-methylpropan-2-amine is sourced from PubChem (CID 103713921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).