(R)-3-ethylpentane-3-sulfinamide

C7H17NOS — CID 11159499

IUPAC(R)-3-ethylpentane-3-sulfinamide
SMILESCCC(CC)(CC)[S@](N)=O
InChIInChI=1S/C7H17NOS/c1-4-7(5-2,6-3)10(8)9/h4-6,8H2,1-3H3/t10-/m1/s1
InChIKeyDDPVOERMBGQAKQ-SNVBAGLBSA-N
MW163.29 g/mol
LogP1.58
Rot. Bonds4

About (R)-3-ethylpentane-3-sulfinamide

(R)-3-ethylpentane-3-sulfinamide (PubChem CID 11159499) has the molecular formula C7H17NOS and a molecular weight of 163.29 g/mol. Its IUPAC name is (R)-3-ethylpentane-3-sulfinamide.

Molecular Properties

Compound Name(R)-3-ethylpentane-3-sulfinamide
PubChem CID11159499
Molecular FormulaC7H17NOS
Molecular Weight163.29 g/mol
Exact Mass163.10
IUPAC Name(R)-3-ethylpentane-3-sulfinamide
SMILESCCC(CC)(CC)[S@](N)=O
InChIInChI=1S/C7H17NOS/c1-4-7(5-2,6-3)10(8)9/h4-6,8H2,1-3H3/t10-/m1/s1
InChIKeyDDPVOERMBGQAKQ-SNVBAGLBSA-N
XLogP1.58
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.29
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

ethanesulfinamide;hydrochloride
CID 155487048
2-methylhexane-2-sulfinamide
CID 123826931
trichloromethanesulfinamide
CID 166682379
tetrakis(3,3-dimethylpentane);methane
CID 159658641
3,3-dimethylpentane;methane
CID 158185076
3,3-dimethylpentane;2,2-dimethylpropane
CID 173299738
ethanol;sulfur trioxide
CID 88617255
3,3-dimethylpentane;propane
CID 90942978
propane sulfite
CID 21270602
2-methylbutane-1-sulfinamide
CID 139559461
3-ethyl-2,2-dimethylpentane-3-sulfinate
CID 57421679
methyl 2-methylbutane-2-sulfinate
CID 134928940

Frequently Asked Questions

What is the IUPAC name of (R)-3-ethylpentane-3-sulfinamide?
The IUPAC name of (R)-3-ethylpentane-3-sulfinamide (CID 11159499) is (R)-3-ethylpentane-3-sulfinamide.
What is the SMILES notation for (R)-3-ethylpentane-3-sulfinamide?
The canonical SMILES for (R)-3-ethylpentane-3-sulfinamide is CCC(CC)(CC)[S@](N)=O.
What is the InChIKey of (R)-3-ethylpentane-3-sulfinamide?
The InChIKey is DDPVOERMBGQAKQ-SNVBAGLBSA-N. The full InChI is InChI=1S/C7H17NOS/c1-4-7(5-2,6-3)10(8)9/h4-6,8H2,1-3H3/t10-/m1/s1.
What are the key properties of (R)-3-ethylpentane-3-sulfinamide?
(R)-3-ethylpentane-3-sulfinamide has a molecular weight of 163.29 g/mol, XLogP of 1.58, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (R)-3-ethylpentane-3-sulfinamide is sourced from PubChem (CID 11159499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).