(R)-N-[(2R,4S)-4-hydroxy-1-pyridin-2-ylpentan-2-yl]-2-methylpropane-2-sulfinamide

C14H24N2O2S — CID 140879318

IUPAC(R)-N-[(2R,4S)-4-hydroxy-1-pyridin-2-ylpentan-2-yl]-2-methylpropane-2-sulfinamide
SMILESC[C@H](O)C[C@@H](Cc1ccccn1)N[S@](=O)C(C)(C)C
InChIInChI=1S/C14H24N2O2S/c1-11(17)9-13(16-19(18)14(2,3)4)10-12-7-5-6-8-15-12/h5-8,11,13,16-17H,9-10H2,1-4H3/t11-,13-,19+/m0/s1
InChIKeyMLHYPCOUDNHYII-MJLGCCKJSA-N
MW284.43 g/mol
LogP1.82
Rot. Bonds6

About (R)-N-[(2R,4S)-4-hydroxy-1-pyridin-2-ylpentan-2-yl]-2-methylpropane-2-sulfinamide

(R)-N-[(2R,4S)-4-hydroxy-1-pyridin-2-ylpentan-2-yl]-2-methylpropane-2-sulfinamide (PubChem CID 140879318) has the molecular formula C14H24N2O2S and a molecular weight of 284.43 g/mol. Its IUPAC name is (R)-N-[(2R,4S)-4-hydroxy-1-pyridin-2-ylpentan-2-yl]-2-methylpropane-2-sulfinamide.

Molecular Properties

Compound Name(R)-N-[(2R,4S)-4-hydroxy-1-pyridin-2-ylpentan-2-yl]-2-methylpropane-2-sulfinamide
PubChem CID140879318
Molecular FormulaC14H24N2O2S
Molecular Weight284.43 g/mol
Exact Mass284.16
IUPAC Name(R)-N-[(2R,4S)-4-hydroxy-1-pyridin-2-ylpentan-2-yl]-2-methylpropane-2-sulfinamide
SMILESC[C@H](O)C[C@@H](Cc1ccccn1)N[S@](=O)C(C)(C)C
InChIInChI=1S/C14H24N2O2S/c1-11(17)9-13(16-19(18)14(2,3)4)10-12-7-5-6-8-15-12/h5-8,11,13,16-17H,9-10H2,1-4H3/t11-,13-,19+/m0/s1
InChIKeyMLHYPCOUDNHYII-MJLGCCKJSA-N
XLogP1.82
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.43
LogP ≤ 51.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze (R)-N-[(2R,4S)-4-hydroxy-1-pyridin-2-ylpentan-2-yl]-2-methylpropane-2-sulfinamide with MolForge

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Related Compounds

N-[(2R)-1-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-3-pyridin-2-ylpropan-2-yl]-2-methylpropane-2-sulfinamide
CID 135138552
(R)-N-[(2R,3R)-3-methoxy-4-phenylmethoxy-1-pyridin-2-ylbutan-2-yl]-2-methylpropane-2-sulfinamide
CID 140879439
2-methyl-N-[(1S)-1-pyridin-2-ylethyl]propane-2-sulfinamide
CID 102512777
4,6,6-trimethyl-1-pyridin-2-ylheptan-2-ol
CID 115810990
3,3-dimethyl-1-pyridin-2-ylbutan-2-ol
CID 62393585
(R)-N-[(1S)-1-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-2-pyridin-2-ylethyl]-2-methylpropane-2-sulfinamide
CID 142384395
(4-methyl-1-pyridin-2-ylpentan-2-yl)hydrazine
CID 105198827
2-methyl-N-[(1S)-2,2,2-trichloro-1-pyridin-2-ylethyl]propane-2-sulfinamide
CID 102484760
4-methyl-5-(pyridin-2-ylmethylamino)pentan-2-ol
CID 115644639
4-methyl-1-pyridin-2-ylpentane-2,3-diol
CID 103456469
ethane;3-methyl-4-pyridin-2-ylbutan-2-one
CID 177154285
(5-methyl-1-pyridin-2-ylhexan-2-yl)hydrazine
CID 105199745

Frequently Asked Questions

What is the IUPAC name of (R)-N-[(2R,4S)-4-hydroxy-1-pyridin-2-ylpentan-2-yl]-2-methylpropane-2-sulfinamide?
The IUPAC name of (R)-N-[(2R,4S)-4-hydroxy-1-pyridin-2-ylpentan-2-yl]-2-methylpropane-2-sulfinamide (CID 140879318) is (R)-N-[(2R,4S)-4-hydroxy-1-pyridin-2-ylpentan-2-yl]-2-methylpropane-2-sulfinamide.
What is the SMILES notation for (R)-N-[(2R,4S)-4-hydroxy-1-pyridin-2-ylpentan-2-yl]-2-methylpropane-2-sulfinamide?
The canonical SMILES for (R)-N-[(2R,4S)-4-hydroxy-1-pyridin-2-ylpentan-2-yl]-2-methylpropane-2-sulfinamide is C[C@H](O)C[C@@H](Cc1ccccn1)N[S@](=O)C(C)(C)C.
What is the InChIKey of (R)-N-[(2R,4S)-4-hydroxy-1-pyridin-2-ylpentan-2-yl]-2-methylpropane-2-sulfinamide?
The InChIKey is MLHYPCOUDNHYII-MJLGCCKJSA-N. The full InChI is InChI=1S/C14H24N2O2S/c1-11(17)9-13(16-19(18)14(2,3)4)10-12-7-5-6-8-15-12/h5-8,11,13,16-17H,9-10H2,1-4H3/t11-,13-,19+/m0/s1.
What are the key properties of (R)-N-[(2R,4S)-4-hydroxy-1-pyridin-2-ylpentan-2-yl]-2-methylpropane-2-sulfinamide?
(R)-N-[(2R,4S)-4-hydroxy-1-pyridin-2-ylpentan-2-yl]-2-methylpropane-2-sulfinamide has a molecular weight of 284.43 g/mol, XLogP of 1.82, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (R)-N-[(2R,4S)-4-hydroxy-1-pyridin-2-ylpentan-2-yl]-2-methylpropane-2-sulfinamide is sourced from PubChem (CID 140879318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).