2-(5-chloro-2-methoxyphenyl)sulfonylpropan-2-amine

C10H14ClNO3S — CID 117036237

IUPAC2-(5-chloro-2-methoxyphenyl)sulfonylpropan-2-amine
SMILESCOc1ccc(Cl)cc1S(=O)(=O)C(C)(C)N
InChIInChI=1S/C10H14ClNO3S/c1-10(2,12)16(13,14)9-6-7(11)4-5-8(9)15-3/h4-6H,12H2,1-3H3
InChIKeyAQXHWYRPWGQGAA-UHFFFAOYSA-N
MW263.75 g/mol
LogP1.82
Rot. Bonds3

About 2-(5-chloro-2-methoxyphenyl)sulfonylpropan-2-amine

2-(5-chloro-2-methoxyphenyl)sulfonylpropan-2-amine (PubChem CID 117036237) has the molecular formula C10H14ClNO3S and a molecular weight of 263.75 g/mol. Its IUPAC name is 2-(5-chloro-2-methoxyphenyl)sulfonylpropan-2-amine.

Molecular Properties

Compound Name2-(5-chloro-2-methoxyphenyl)sulfonylpropan-2-amine
PubChem CID117036237
Molecular FormulaC10H14ClNO3S
Molecular Weight263.75 g/mol
Exact Mass263.04
IUPAC Name2-(5-chloro-2-methoxyphenyl)sulfonylpropan-2-amine
SMILESCOc1ccc(Cl)cc1S(=O)(=O)C(C)(C)N
InChIInChI=1S/C10H14ClNO3S/c1-10(2,12)16(13,14)9-6-7(11)4-5-8(9)15-3/h4-6H,12H2,1-3H3
InChIKeyAQXHWYRPWGQGAA-UHFFFAOYSA-N
XLogP1.82
TPSA69.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.75
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-methoxy-5-methylphenyl)sulfonylpropan-2-amine
CID 117036219
methyl 5-chloro-2-methoxybenzenesulfonate
CID 89056294
CID 70601990
CID 70601990
5-chloro-N-hydroxy-2-methoxybenzenesulfonamide
CID 82083952
4-(5-chloro-2-methoxyphenyl)sulfonylthiomorpholine
CID 27241340
N-(1-amino-2-methylpropan-2-yl)-5-chloro-2-methoxybenzenesulfonamide
CID 82345223
1-(5-chloro-2-methoxyphenyl)sulfonylpiperidine
CID 757936
5-chloro-N-(5-chloro-2-methoxyphenyl)-2-methoxybenzenesulfonamide
CID 1326389
4-(5-chloro-2-methoxyphenyl)sulfonylmorpholine
CID 5201304
5-chloro-N-(2-hydroxy-2-methylpropyl)-2-methoxybenzenesulfonamide
CID 110287793
5-chloro-N-(4-chlorophenyl)-2-methoxy-N-methylbenzenesulfonamide
CID 3517707
1-(5-chloro-2-methoxyphenyl)sulfonyl-2,5-dihydropyrrole
CID 3291316

Frequently Asked Questions

What is the IUPAC name of 2-(5-chloro-2-methoxyphenyl)sulfonylpropan-2-amine?
The IUPAC name of 2-(5-chloro-2-methoxyphenyl)sulfonylpropan-2-amine (CID 117036237) is 2-(5-chloro-2-methoxyphenyl)sulfonylpropan-2-amine.
What is the SMILES notation for 2-(5-chloro-2-methoxyphenyl)sulfonylpropan-2-amine?
The canonical SMILES for 2-(5-chloro-2-methoxyphenyl)sulfonylpropan-2-amine is COc1ccc(Cl)cc1S(=O)(=O)C(C)(C)N.
What is the InChIKey of 2-(5-chloro-2-methoxyphenyl)sulfonylpropan-2-amine?
The InChIKey is AQXHWYRPWGQGAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14ClNO3S/c1-10(2,12)16(13,14)9-6-7(11)4-5-8(9)15-3/h4-6H,12H2,1-3H3.
What are the key properties of 2-(5-chloro-2-methoxyphenyl)sulfonylpropan-2-amine?
2-(5-chloro-2-methoxyphenyl)sulfonylpropan-2-amine has a molecular weight of 263.75 g/mol, XLogP of 1.82, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-chloro-2-methoxyphenyl)sulfonylpropan-2-amine is sourced from PubChem (CID 117036237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).