(R)-N-[(2S)-3-fluoro-4-methylpent-3-en-2-yl]-2-methylpropane-2-sulfinamide

C10H20FNOS — CID 176786703

IUPAC(R)-N-[(2S)-3-fluoro-4-methylpent-3-en-2-yl]-2-methylpropane-2-sulfinamide
SMILESCC(C)=C(F)[C@H](C)N[S@](=O)C(C)(C)C
InChIInChI=1S/C10H20FNOS/c1-7(2)9(11)8(3)12-14(13)10(4,5)6/h8,12H,1-6H3/t8-,14+/m0/s1
InChIKeyMCPVZWRQNZXAMG-RMLUDKJBSA-N
MW221.34 g/mol
LogP2.69
Rot. Bonds3

About (R)-N-[(2S)-3-fluoro-4-methylpent-3-en-2-yl]-2-methylpropane-2-sulfinamide

(R)-N-[(2S)-3-fluoro-4-methylpent-3-en-2-yl]-2-methylpropane-2-sulfinamide (PubChem CID 176786703) has the molecular formula C10H20FNOS and a molecular weight of 221.34 g/mol. Its IUPAC name is (R)-N-[(2S)-3-fluoro-4-methylpent-3-en-2-yl]-2-methylpropane-2-sulfinamide.

Molecular Properties

Compound Name(R)-N-[(2S)-3-fluoro-4-methylpent-3-en-2-yl]-2-methylpropane-2-sulfinamide
PubChem CID176786703
Molecular FormulaC10H20FNOS
Molecular Weight221.34 g/mol
Exact Mass221.12
IUPAC Name(R)-N-[(2S)-3-fluoro-4-methylpent-3-en-2-yl]-2-methylpropane-2-sulfinamide
SMILESCC(C)=C(F)[C@H](C)N[S@](=O)C(C)(C)C
InChIInChI=1S/C10H20FNOS/c1-7(2)9(11)8(3)12-14(13)10(4,5)6/h8,12H,1-6H3/t8-,14+/m0/s1
InChIKeyMCPVZWRQNZXAMG-RMLUDKJBSA-N
XLogP2.69
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.34
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (R)-N-[(2S)-3-fluoro-4-methylpent-3-en-2-yl]-2-methylpropane-2-sulfinamide?
The IUPAC name of (R)-N-[(2S)-3-fluoro-4-methylpent-3-en-2-yl]-2-methylpropane-2-sulfinamide (CID 176786703) is (R)-N-[(2S)-3-fluoro-4-methylpent-3-en-2-yl]-2-methylpropane-2-sulfinamide.
What is the SMILES notation for (R)-N-[(2S)-3-fluoro-4-methylpent-3-en-2-yl]-2-methylpropane-2-sulfinamide?
The canonical SMILES for (R)-N-[(2S)-3-fluoro-4-methylpent-3-en-2-yl]-2-methylpropane-2-sulfinamide is CC(C)=C(F)[C@H](C)N[S@](=O)C(C)(C)C.
What is the InChIKey of (R)-N-[(2S)-3-fluoro-4-methylpent-3-en-2-yl]-2-methylpropane-2-sulfinamide?
The InChIKey is MCPVZWRQNZXAMG-RMLUDKJBSA-N. The full InChI is InChI=1S/C10H20FNOS/c1-7(2)9(11)8(3)12-14(13)10(4,5)6/h8,12H,1-6H3/t8-,14+/m0/s1.
What are the key properties of (R)-N-[(2S)-3-fluoro-4-methylpent-3-en-2-yl]-2-methylpropane-2-sulfinamide?
(R)-N-[(2S)-3-fluoro-4-methylpent-3-en-2-yl]-2-methylpropane-2-sulfinamide has a molecular weight of 221.34 g/mol, XLogP of 2.69, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (R)-N-[(2S)-3-fluoro-4-methylpent-3-en-2-yl]-2-methylpropane-2-sulfinamide is sourced from PubChem (CID 176786703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).