[4-(2,3-dichlorophenyl)sulfonylmorpholin-2-yl]methanamine

C11H14Cl2N2O3S — CID 114398436

IUPAC[4-(2,3-dichlorophenyl)sulfonylmorpholin-2-yl]methanamine
SMILESNCC1CN(S(=O)(=O)c2cccc(Cl)c2Cl)CCO1
InChIInChI=1S/C11H14Cl2N2O3S/c12-9-2-1-3-10(11(9)13)19(16,17)15-4-5-18-8(6-14)7-15/h1-3,8H,4-7,14H2
InChIKeyKQJRTQPWQYQZDR-UHFFFAOYSA-N
MW325.22 g/mol
LogP1.34
Rot. Bonds3

About [4-(2,3-dichlorophenyl)sulfonylmorpholin-2-yl]methanamine

[4-(2,3-dichlorophenyl)sulfonylmorpholin-2-yl]methanamine (PubChem CID 114398436) has the molecular formula C11H14Cl2N2O3S and a molecular weight of 325.22 g/mol. Its IUPAC name is [4-(2,3-dichlorophenyl)sulfonylmorpholin-2-yl]methanamine.

Molecular Properties

Compound Name[4-(2,3-dichlorophenyl)sulfonylmorpholin-2-yl]methanamine
PubChem CID114398436
Molecular FormulaC11H14Cl2N2O3S
Molecular Weight325.22 g/mol
Exact Mass324.01
IUPAC Name[4-(2,3-dichlorophenyl)sulfonylmorpholin-2-yl]methanamine
SMILESNCC1CN(S(=O)(=O)c2cccc(Cl)c2Cl)CCO1
InChIInChI=1S/C11H14Cl2N2O3S/c12-9-2-1-3-10(11(9)13)19(16,17)15-4-5-18-8(6-14)7-15/h1-3,8H,4-7,14H2
InChIKeyKQJRTQPWQYQZDR-UHFFFAOYSA-N
XLogP1.34
TPSA72.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.22
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[(2R)-4-(4-chlorophenyl)sulfonylmorpholin-2-yl]methanamine
CID 42252815
[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)morpholin-2-yl]methanamine
CID 114398484
[4-(3,5-dichlorophenyl)sulfonylmorpholin-2-yl]methanamine
CID 114398478
[(2R)-4-(3-methylphenyl)sulfonylmorpholin-2-yl]methanamine
CID 42252952
[4-(2,3,4-trifluorophenyl)sulfonylmorpholin-2-yl]methanamine
CID 114398416
2-[4-(3-chloro-2-fluorophenyl)sulfonylmorpholin-2-yl]acetic acid
CID 66434008
[4-(5-fluoro-2-methylphenyl)sulfonylmorpholin-2-yl]methanamine
CID 61339337
[4-(3-chloro-4-methoxyphenyl)sulfonylmorpholin-2-yl]methanamine
CID 114398495
[4-[1-(2,3-dichlorophenyl)ethyl]morpholin-2-yl]methanamine
CID 114079708
[4-(2,5-dimethoxyphenyl)sulfonylmorpholin-2-yl]methanamine
CID 114398431
2-[[4-(3-chloro-2-methylphenyl)sulfonylmorpholin-2-yl]methyl-methylamino]acetic acid
CID 122072081
[4-(4-amino-2-chlorophenyl)sulfonylmorpholin-2-yl]methanol
CID 81206052

Frequently Asked Questions

What is the IUPAC name of [4-(2,3-dichlorophenyl)sulfonylmorpholin-2-yl]methanamine?
The IUPAC name of [4-(2,3-dichlorophenyl)sulfonylmorpholin-2-yl]methanamine (CID 114398436) is [4-(2,3-dichlorophenyl)sulfonylmorpholin-2-yl]methanamine.
What is the SMILES notation for [4-(2,3-dichlorophenyl)sulfonylmorpholin-2-yl]methanamine?
The canonical SMILES for [4-(2,3-dichlorophenyl)sulfonylmorpholin-2-yl]methanamine is NCC1CN(S(=O)(=O)c2cccc(Cl)c2Cl)CCO1.
What is the InChIKey of [4-(2,3-dichlorophenyl)sulfonylmorpholin-2-yl]methanamine?
The InChIKey is KQJRTQPWQYQZDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14Cl2N2O3S/c12-9-2-1-3-10(11(9)13)19(16,17)15-4-5-18-8(6-14)7-15/h1-3,8H,4-7,14H2.
What are the key properties of [4-(2,3-dichlorophenyl)sulfonylmorpholin-2-yl]methanamine?
[4-(2,3-dichlorophenyl)sulfonylmorpholin-2-yl]methanamine has a molecular weight of 325.22 g/mol, XLogP of 1.34, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2,3-dichlorophenyl)sulfonylmorpholin-2-yl]methanamine is sourced from PubChem (CID 114398436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).