(R)-N-[(1S)-1-(2,3-dihydro-1H-indol-4-yl)ethyl]-2-methylpropane-2-sulfinamide

C14H22N2OS — CID 172908301

IUPAC(R)-N-[(1S)-1-(2,3-dihydro-1H-indol-4-yl)ethyl]-2-methylpropane-2-sulfinamide
SMILESC[C@H](N[S@](=O)C(C)(C)C)c1cccc2c1CCN2
InChIInChI=1S/C14H22N2OS/c1-10(16-18(17)14(2,3)4)11-6-5-7-13-12(11)8-9-15-13/h5-7,10,15-16H,8-9H2,1-4H3/t10-,18+/m0/s1
InChIKeyYZXZUZFFNWBGGM-XTZNXHDOSA-N
MW266.41 g/mol
LogP2.77
Rot. Bonds3

About (R)-N-[(1S)-1-(2,3-dihydro-1H-indol-4-yl)ethyl]-2-methylpropane-2-sulfinamide

(R)-N-[(1S)-1-(2,3-dihydro-1H-indol-4-yl)ethyl]-2-methylpropane-2-sulfinamide (PubChem CID 172908301) has the molecular formula C14H22N2OS and a molecular weight of 266.41 g/mol. Its IUPAC name is (R)-N-[(1S)-1-(2,3-dihydro-1H-indol-4-yl)ethyl]-2-methylpropane-2-sulfinamide.

Molecular Properties

Compound Name(R)-N-[(1S)-1-(2,3-dihydro-1H-indol-4-yl)ethyl]-2-methylpropane-2-sulfinamide
PubChem CID172908301
Molecular FormulaC14H22N2OS
Molecular Weight266.41 g/mol
Exact Mass266.15
IUPAC Name(R)-N-[(1S)-1-(2,3-dihydro-1H-indol-4-yl)ethyl]-2-methylpropane-2-sulfinamide
SMILESC[C@H](N[S@](=O)C(C)(C)C)c1cccc2c1CCN2
InChIInChI=1S/C14H22N2OS/c1-10(16-18(17)14(2,3)4)11-6-5-7-13-12(11)8-9-15-13/h5-7,10,15-16H,8-9H2,1-4H3/t10-,18+/m0/s1
InChIKeyYZXZUZFFNWBGGM-XTZNXHDOSA-N
XLogP2.77
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.41
LogP ≤ 52.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze (R)-N-[(1S)-1-(2,3-dihydro-1H-indol-4-yl)ethyl]-2-methylpropane-2-sulfinamide with MolForge

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Related Compounds

2-(2,3-dihydro-1H-indol-4-yl)propanoic acid
CID 117119033
(R)-N-[1-(2-chloro-3-fluorophenyl)ethyl]-2-methylpropane-2-sulfinamide
CID 172536184
N-[(1R)-1-[2-fluoro-3-(trifluoromethylsulfonyl)phenyl]ethyl]-2-methylpropane-2-sulfinamide
CID 170428484
(R)-2-methyl-N-[(1S)-1-(1-methylindazol-4-yl)ethyl]propane-2-sulfinamide
CID 156778664
N-[1-[3-(1,1-difluoro-2-hydroxy-2-methylpropyl)-2-fluorophenyl]ethyl]-2-methylpropane-2-sulfinamide
CID 162452444
(R)-2-methyl-N-[1-(3-methylphenyl)ethyl]propane-2-sulfinamide
CID 140937180
1-(2,3-dihydro-1H-indol-4-ylamino)-2-methylpropan-2-ol
CID 171813583
2-methyl-N-[(1S)-1-pyridin-3-ylethyl]propane-2-sulfinamide
CID 102512778
2-methyl-N-[(1R)-1-pyridin-3-ylethyl]propane-2-sulfinamide
CID 102512780
2-methyl-N-[(1S)-1-pyridin-2-ylethyl]propane-2-sulfinamide
CID 102512777
(S)-N-[(1R)-1-(furan-2-yl)ethyl]-2-methylpropane-2-sulfinamide
CID 71288215
N-[(1R)-1-(2,5-difluorophenyl)ethyl]-2-methylpropane-2-sulfinamide
CID 138690058

Frequently Asked Questions

What is the IUPAC name of (R)-N-[(1S)-1-(2,3-dihydro-1H-indol-4-yl)ethyl]-2-methylpropane-2-sulfinamide?
The IUPAC name of (R)-N-[(1S)-1-(2,3-dihydro-1H-indol-4-yl)ethyl]-2-methylpropane-2-sulfinamide (CID 172908301) is (R)-N-[(1S)-1-(2,3-dihydro-1H-indol-4-yl)ethyl]-2-methylpropane-2-sulfinamide.
What is the SMILES notation for (R)-N-[(1S)-1-(2,3-dihydro-1H-indol-4-yl)ethyl]-2-methylpropane-2-sulfinamide?
The canonical SMILES for (R)-N-[(1S)-1-(2,3-dihydro-1H-indol-4-yl)ethyl]-2-methylpropane-2-sulfinamide is C[C@H](N[S@](=O)C(C)(C)C)c1cccc2c1CCN2.
What is the InChIKey of (R)-N-[(1S)-1-(2,3-dihydro-1H-indol-4-yl)ethyl]-2-methylpropane-2-sulfinamide?
The InChIKey is YZXZUZFFNWBGGM-XTZNXHDOSA-N. The full InChI is InChI=1S/C14H22N2OS/c1-10(16-18(17)14(2,3)4)11-6-5-7-13-12(11)8-9-15-13/h5-7,10,15-16H,8-9H2,1-4H3/t10-,18+/m0/s1.
What are the key properties of (R)-N-[(1S)-1-(2,3-dihydro-1H-indol-4-yl)ethyl]-2-methylpropane-2-sulfinamide?
(R)-N-[(1S)-1-(2,3-dihydro-1H-indol-4-yl)ethyl]-2-methylpropane-2-sulfinamide has a molecular weight of 266.41 g/mol, XLogP of 2.77, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (R)-N-[(1S)-1-(2,3-dihydro-1H-indol-4-yl)ethyl]-2-methylpropane-2-sulfinamide is sourced from PubChem (CID 172908301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).