N-[(2R)-1-aminopropan-2-yl]-2-methoxybenzenesulfonamide

C10H16N2O3S — CID 104873312

IUPACN-[(2R)-1-aminopropan-2-yl]-2-methoxybenzenesulfonamide
SMILESCOc1ccccc1S(=O)(=O)N[C@H](C)CN
InChIInChI=1S/C10H16N2O3S/c1-8(7-11)12-16(13,14)10-6-4-3-5-9(10)15-2/h3-6,8,12H,7,11H2,1-2H3/t8-/m1/s1
InChIKeyQNFDPHVFQQORSY-MRVPVSSYSA-N
MW244.32 g/mol
LogP0.32
Rot. Bonds5

About N-[(2R)-1-aminopropan-2-yl]-2-methoxybenzenesulfonamide

N-[(2R)-1-aminopropan-2-yl]-2-methoxybenzenesulfonamide (PubChem CID 104873312) has the molecular formula C10H16N2O3S and a molecular weight of 244.32 g/mol. Its IUPAC name is N-[(2R)-1-aminopropan-2-yl]-2-methoxybenzenesulfonamide.

Molecular Properties

Compound NameN-[(2R)-1-aminopropan-2-yl]-2-methoxybenzenesulfonamide
PubChem CID104873312
Molecular FormulaC10H16N2O3S
Molecular Weight244.32 g/mol
Exact Mass244.09
IUPAC NameN-[(2R)-1-aminopropan-2-yl]-2-methoxybenzenesulfonamide
SMILESCOc1ccccc1S(=O)(=O)N[C@H](C)CN
InChIInChI=1S/C10H16N2O3S/c1-8(7-11)12-16(13,14)10-6-4-3-5-9(10)15-2/h3-6,8,12H,7,11H2,1-2H3/t8-/m1/s1
InChIKeyQNFDPHVFQQORSY-MRVPVSSYSA-N
XLogP0.32
TPSA81.42 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.32
LogP ≤ 50.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(2R)-1-hydroxypropan-2-yl]-2-methoxybenzenesulfonamide
CID 79027643
N-[(2S)-1-aminopropan-2-yl]-2-(trifluoromethoxy)benzenesulfonamide
CID 98539299
N-[(2S)-1-aminopropan-2-yl]-5-chloro-2-methoxybenzenesulfonamide;hydrochloride
CID 120713181
methyl 2-[(2-methoxyphenyl)sulfonylamino]propanoate
CID 60639230
N-[(2R)-1-aminopropan-2-yl]-2-chlorobenzenesulfonamide
CID 104873370
2-methoxy-N-(2-methylpropyl)benzenesulfonamide
CID 47104188
N-(3-aminopropyl)-2-methoxybenzenesulfonamide
CID 43605820
N-(1-aminopropan-2-yl)-4-methoxybenzenesulfonamide
CID 61123975
N-[(2S)-1-aminopropan-2-yl]-2-pyrrolidin-1-ylsulfonylbenzenesulfonamide
CID 120713101
2-methoxy-N-propylbenzenesulfonamide
CID 23128752
2-(2-methoxyphenyl)sulfonylbutan-1-amine
CID 64698684
2-(3-aminopropoxy)-N-propan-2-ylbenzenesulfonamide
CID 62347850

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-1-aminopropan-2-yl]-2-methoxybenzenesulfonamide?
The IUPAC name of N-[(2R)-1-aminopropan-2-yl]-2-methoxybenzenesulfonamide (CID 104873312) is N-[(2R)-1-aminopropan-2-yl]-2-methoxybenzenesulfonamide.
What is the SMILES notation for N-[(2R)-1-aminopropan-2-yl]-2-methoxybenzenesulfonamide?
The canonical SMILES for N-[(2R)-1-aminopropan-2-yl]-2-methoxybenzenesulfonamide is COc1ccccc1S(=O)(=O)N[C@H](C)CN.
What is the InChIKey of N-[(2R)-1-aminopropan-2-yl]-2-methoxybenzenesulfonamide?
The InChIKey is QNFDPHVFQQORSY-MRVPVSSYSA-N. The full InChI is InChI=1S/C10H16N2O3S/c1-8(7-11)12-16(13,14)10-6-4-3-5-9(10)15-2/h3-6,8,12H,7,11H2,1-2H3/t8-/m1/s1.
What are the key properties of N-[(2R)-1-aminopropan-2-yl]-2-methoxybenzenesulfonamide?
N-[(2R)-1-aminopropan-2-yl]-2-methoxybenzenesulfonamide has a molecular weight of 244.32 g/mol, XLogP of 0.32, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-1-aminopropan-2-yl]-2-methoxybenzenesulfonamide is sourced from PubChem (CID 104873312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).