(R)-2-methyl-N-[(2S,4S)-4-phenyl-1,2,3,4-tetrahydronaphthalen-2-yl]propane-2-sulfinamide

C20H25NOS — CID 56933946

IUPAC(R)-2-methyl-N-[(2S,4S)-4-phenyl-1,2,3,4-tetrahydronaphthalen-2-yl]propane-2-sulfinamide
SMILESCC(C)(C)[S@@](=O)N[C@@H]1Cc2ccccc2[C@H](c2ccccc2)C1
InChIInChI=1S/C20H25NOS/c1-20(2,3)23(22)21-17-13-16-11-7-8-12-18(16)19(14-17)15-9-5-4-6-10-15/h4-12,17,19,21H,13-14H2,1-3H3/t17-,19+,23-/m1/s1
InChIKeyOLICRFNNYZLNBK-HFJQGTKSSA-N
MW327.49 g/mol
LogP4.19
Rot. Bonds3

About (R)-2-methyl-N-[(2S,4S)-4-phenyl-1,2,3,4-tetrahydronaphthalen-2-yl]propane-2-sulfinamide

(R)-2-methyl-N-[(2S,4S)-4-phenyl-1,2,3,4-tetrahydronaphthalen-2-yl]propane-2-sulfinamide (PubChem CID 56933946) has the molecular formula C20H25NOS and a molecular weight of 327.49 g/mol. Its IUPAC name is (R)-2-methyl-N-[(2S,4S)-4-phenyl-1,2,3,4-tetrahydronaphthalen-2-yl]propane-2-sulfinamide.

Molecular Properties

Compound Name(R)-2-methyl-N-[(2S,4S)-4-phenyl-1,2,3,4-tetrahydronaphthalen-2-yl]propane-2-sulfinamide
PubChem CID56933946
Molecular FormulaC20H25NOS
Molecular Weight327.49 g/mol
Exact Mass327.17
IUPAC Name(R)-2-methyl-N-[(2S,4S)-4-phenyl-1,2,3,4-tetrahydronaphthalen-2-yl]propane-2-sulfinamide
SMILESCC(C)(C)[S@@](=O)N[C@@H]1Cc2ccccc2[C@H](c2ccccc2)C1
InChIInChI=1S/C20H25NOS/c1-20(2,3)23(22)21-17-13-16-11-7-8-12-18(16)19(14-17)15-9-5-4-6-10-15/h4-12,17,19,21H,13-14H2,1-3H3/t17-,19+,23-/m1/s1
InChIKeyOLICRFNNYZLNBK-HFJQGTKSSA-N
XLogP4.19
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.49
LogP ≤ 54.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (R)-2-methyl-N-[(2S,4S)-4-phenyl-1,2,3,4-tetrahydronaphthalen-2-yl]propane-2-sulfinamide?
The IUPAC name of (R)-2-methyl-N-[(2S,4S)-4-phenyl-1,2,3,4-tetrahydronaphthalen-2-yl]propane-2-sulfinamide (CID 56933946) is (R)-2-methyl-N-[(2S,4S)-4-phenyl-1,2,3,4-tetrahydronaphthalen-2-yl]propane-2-sulfinamide.
What is the SMILES notation for (R)-2-methyl-N-[(2S,4S)-4-phenyl-1,2,3,4-tetrahydronaphthalen-2-yl]propane-2-sulfinamide?
The canonical SMILES for (R)-2-methyl-N-[(2S,4S)-4-phenyl-1,2,3,4-tetrahydronaphthalen-2-yl]propane-2-sulfinamide is CC(C)(C)[S@@](=O)N[C@@H]1Cc2ccccc2[C@H](c2ccccc2)C1.
What is the InChIKey of (R)-2-methyl-N-[(2S,4S)-4-phenyl-1,2,3,4-tetrahydronaphthalen-2-yl]propane-2-sulfinamide?
The InChIKey is OLICRFNNYZLNBK-HFJQGTKSSA-N. The full InChI is InChI=1S/C20H25NOS/c1-20(2,3)23(22)21-17-13-16-11-7-8-12-18(16)19(14-17)15-9-5-4-6-10-15/h4-12,17,19,21H,13-14H2,1-3H3/t17-,19+,23-/m1/s1.
What are the key properties of (R)-2-methyl-N-[(2S,4S)-4-phenyl-1,2,3,4-tetrahydronaphthalen-2-yl]propane-2-sulfinamide?
(R)-2-methyl-N-[(2S,4S)-4-phenyl-1,2,3,4-tetrahydronaphthalen-2-yl]propane-2-sulfinamide has a molecular weight of 327.49 g/mol, XLogP of 4.19, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (R)-2-methyl-N-[(2S,4S)-4-phenyl-1,2,3,4-tetrahydronaphthalen-2-yl]propane-2-sulfinamide is sourced from PubChem (CID 56933946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).