(R)-N-(7-bromo-3,4-dihydronaphthalen-1-yl)-2-methylpropane-2-sulfinamide

C14H18BrNOS — CID 123469634

IUPAC(R)-N-(7-bromo-3,4-dihydronaphthalen-1-yl)-2-methylpropane-2-sulfinamide
SMILESCC(C)(C)[S@@](=O)NC1=CCCc2ccc(Br)cc21
InChIInChI=1S/C14H18BrNOS/c1-14(2,3)18(17)16-13-6-4-5-10-7-8-11(15)9-12(10)13/h6-9,16H,4-5H2,1-3H3/t18-/m1/s1
InChIKeyWBXNXGNTJVIAMM-GOSISDBHSA-N
MW328.28 g/mol
LogP3.79
Rot. Bonds2

About (R)-N-(7-bromo-3,4-dihydronaphthalen-1-yl)-2-methylpropane-2-sulfinamide

(R)-N-(7-bromo-3,4-dihydronaphthalen-1-yl)-2-methylpropane-2-sulfinamide (PubChem CID 123469634) has the molecular formula C14H18BrNOS and a molecular weight of 328.28 g/mol. Its IUPAC name is (R)-N-(7-bromo-3,4-dihydronaphthalen-1-yl)-2-methylpropane-2-sulfinamide.

Molecular Properties

Compound Name(R)-N-(7-bromo-3,4-dihydronaphthalen-1-yl)-2-methylpropane-2-sulfinamide
PubChem CID123469634
Molecular FormulaC14H18BrNOS
Molecular Weight328.28 g/mol
Exact Mass327.03
IUPAC Name(R)-N-(7-bromo-3,4-dihydronaphthalen-1-yl)-2-methylpropane-2-sulfinamide
SMILESCC(C)(C)[S@@](=O)NC1=CCCc2ccc(Br)cc21
InChIInChI=1S/C14H18BrNOS/c1-14(2,3)18(17)16-13-6-4-5-10-7-8-11(15)9-12(10)13/h6-9,16H,4-5H2,1-3H3/t18-/m1/s1
InChIKeyWBXNXGNTJVIAMM-GOSISDBHSA-N
XLogP3.79
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.28
LogP ≤ 53.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-methyl-N-[6-(trifluoromethyl)-3H-inden-1-yl]propane-2-sulfinamide
CID 123438705
(R)-N-(6-bromo-2,3-dihydroinden-1-ylidene)-2-methylpropane-2-sulfinamide
CID 71078736
N-(6-bromospiro[2,3-dihydro-1H-naphthalene-4,3'-cyclopropene]-1'-yl)-2-methylpropane-2-sulfinamide
CID 123278915
acetic acid;6-bromo-4-methyl-1,2-dihydronaphthalene
CID 67781269
(NE,R)-N-(7-bromo-3,4-dihydro-2H-naphthalen-1-ylidene)-2-methylpropane-2-sulfinamide
CID 89253723
N-(7-bromo-3,4-dihydro-2H-naphthalen-1-ylidene)-2-methylpropane-2-sulfinamide
CID 67979348
(7-bromo-3,4-dihydronaphthalen-1-yl) acetate
CID 143237438
2-(7-bromo-3,4-dihydronaphthalen-1-yl)ethanol
CID 102513348
5-bromo-3-methyl-1H-isoindole
CID 20744879
(2R)-7-bromo-2-tert-butyl-3,4-dihydro-2H-naphthalen-1-one
CID 124565300
N-[3-(4-bromo-2-chlorophenyl)oxetan-3-yl]-2-methylpropane-2-sulfinamide
CID 130407805
8-(2-aminopropan-2-yl)-5,6-dihydronaphthalen-2-ol
CID 105455610

Frequently Asked Questions

What is the IUPAC name of (R)-N-(7-bromo-3,4-dihydronaphthalen-1-yl)-2-methylpropane-2-sulfinamide?
The IUPAC name of (R)-N-(7-bromo-3,4-dihydronaphthalen-1-yl)-2-methylpropane-2-sulfinamide (CID 123469634) is (R)-N-(7-bromo-3,4-dihydronaphthalen-1-yl)-2-methylpropane-2-sulfinamide.
What is the SMILES notation for (R)-N-(7-bromo-3,4-dihydronaphthalen-1-yl)-2-methylpropane-2-sulfinamide?
The canonical SMILES for (R)-N-(7-bromo-3,4-dihydronaphthalen-1-yl)-2-methylpropane-2-sulfinamide is CC(C)(C)[S@@](=O)NC1=CCCc2ccc(Br)cc21.
What is the InChIKey of (R)-N-(7-bromo-3,4-dihydronaphthalen-1-yl)-2-methylpropane-2-sulfinamide?
The InChIKey is WBXNXGNTJVIAMM-GOSISDBHSA-N. The full InChI is InChI=1S/C14H18BrNOS/c1-14(2,3)18(17)16-13-6-4-5-10-7-8-11(15)9-12(10)13/h6-9,16H,4-5H2,1-3H3/t18-/m1/s1.
What are the key properties of (R)-N-(7-bromo-3,4-dihydronaphthalen-1-yl)-2-methylpropane-2-sulfinamide?
(R)-N-(7-bromo-3,4-dihydronaphthalen-1-yl)-2-methylpropane-2-sulfinamide has a molecular weight of 328.28 g/mol, XLogP of 3.79, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (R)-N-(7-bromo-3,4-dihydronaphthalen-1-yl)-2-methylpropane-2-sulfinamide is sourced from PubChem (CID 123469634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).