4-(4-bromonaphthalen-1-yl)sulfonylmorpholine

C14H14BrNO3S — CID 1372559

IUPAC4-(4-bromonaphthalen-1-yl)sulfonylmorpholine
SMILESO=S(=O)(c1ccc(Br)c2ccccc12)N1CCOCC1
InChIInChI=1S/C14H14BrNO3S/c15-13-5-6-14(12-4-2-1-3-11(12)13)20(17,18)16-7-9-19-10-8-16/h1-6H,7-10H2
InChIKeyAMPUCZLSAIJQQB-UHFFFAOYSA-N
MW356.24 g/mol
LogP2.62
Rot. Bonds2

About 4-(4-bromonaphthalen-1-yl)sulfonylmorpholine

4-(4-bromonaphthalen-1-yl)sulfonylmorpholine (PubChem CID 1372559) has the molecular formula C14H14BrNO3S and a molecular weight of 356.24 g/mol. Its IUPAC name is 4-(4-bromonaphthalen-1-yl)sulfonylmorpholine.

Molecular Properties

Compound Name4-(4-bromonaphthalen-1-yl)sulfonylmorpholine
PubChem CID1372559
Molecular FormulaC14H14BrNO3S
Molecular Weight356.24 g/mol
Exact Mass354.99
IUPAC Name4-(4-bromonaphthalen-1-yl)sulfonylmorpholine
SMILESO=S(=O)(c1ccc(Br)c2ccccc12)N1CCOCC1
InChIInChI=1S/C14H14BrNO3S/c15-13-5-6-14(12-4-2-1-3-11(12)13)20(17,18)16-7-9-19-10-8-16/h1-6H,7-10H2
InChIKeyAMPUCZLSAIJQQB-UHFFFAOYSA-N
XLogP2.62
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.24
LogP ≤ 52.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 4-(4-bromonaphthalen-1-yl)sulfonylmorpholine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(4-bromonaphthalen-1-yl)sulfonylazepane
CID 1075093
2-morpholin-4-ylsulfonylbenzenesulfonamide
CID 43342653
4-bromo-N-(2-morpholin-4-ylethyl)naphthalene-1-sulfonamide
CID 16644689
2-morpholin-4-ylsulfonylphenol
CID 79020270
4-(2-chlorophenyl)sulfonylmorpholine
CID 7938037
4-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)sulfonyl]morpholine
CID 48944322
4-bromo-3-morpholin-4-ylsulfonylbenzoate
CID 3668553
[4-(2-bromophenyl)sulfonylpiperazin-1-yl]-morpholin-4-ylmethanone
CID 55476348
2-(4-morpholin-4-ylsulfonyl-1-oxoisoquinolin-2-yl)acetic acid
CID 53212250
3-bromo-5-morpholin-4-ylsulfonyl-1H-pyridin-4-one
CID 102538904
4-(benzenesulfonyl)morpholine;ethane
CID 143200179
2-bromo-5-morpholin-4-ylsulfonylaniline
CID 115328547

Frequently Asked Questions

What is the IUPAC name of 4-(4-bromonaphthalen-1-yl)sulfonylmorpholine?
The IUPAC name of 4-(4-bromonaphthalen-1-yl)sulfonylmorpholine (CID 1372559) is 4-(4-bromonaphthalen-1-yl)sulfonylmorpholine.
What is the SMILES notation for 4-(4-bromonaphthalen-1-yl)sulfonylmorpholine?
The canonical SMILES for 4-(4-bromonaphthalen-1-yl)sulfonylmorpholine is O=S(=O)(c1ccc(Br)c2ccccc12)N1CCOCC1.
What is the InChIKey of 4-(4-bromonaphthalen-1-yl)sulfonylmorpholine?
The InChIKey is AMPUCZLSAIJQQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14BrNO3S/c15-13-5-6-14(12-4-2-1-3-11(12)13)20(17,18)16-7-9-19-10-8-16/h1-6H,7-10H2.
What are the key properties of 4-(4-bromonaphthalen-1-yl)sulfonylmorpholine?
4-(4-bromonaphthalen-1-yl)sulfonylmorpholine has a molecular weight of 356.24 g/mol, XLogP of 2.62, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-bromonaphthalen-1-yl)sulfonylmorpholine is sourced from PubChem (CID 1372559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).