2-methyl-N-(4-methylpentan-2-yl)propane-2-sulfinamide

C10H23NOS — CID 73008898

IUPAC2-methyl-N-(4-methylpentan-2-yl)propane-2-sulfinamide
SMILESCC(C)CC(C)NS(=O)C(C)(C)C
InChIInChI=1S/C10H23NOS/c1-8(2)7-9(3)11-13(12)10(4,5)6/h8-9,11H,7H2,1-6H3
InChIKeySQNVCPUAUAYWRT-UHFFFAOYSA-N
MW205.37 g/mol
LogP2.47
Rot. Bonds4

About 2-methyl-N-(4-methylpentan-2-yl)propane-2-sulfinamide

2-methyl-N-(4-methylpentan-2-yl)propane-2-sulfinamide (PubChem CID 73008898) has the molecular formula C10H23NOS and a molecular weight of 205.37 g/mol. Its IUPAC name is 2-methyl-N-(4-methylpentan-2-yl)propane-2-sulfinamide.

Molecular Properties

Compound Name2-methyl-N-(4-methylpentan-2-yl)propane-2-sulfinamide
PubChem CID73008898
Molecular FormulaC10H23NOS
Molecular Weight205.37 g/mol
Exact Mass205.15
IUPAC Name2-methyl-N-(4-methylpentan-2-yl)propane-2-sulfinamide
SMILESCC(C)CC(C)NS(=O)C(C)(C)C
InChIInChI=1S/C10H23NOS/c1-8(2)7-9(3)11-13(12)10(4,5)6/h8-9,11H,7H2,1-6H3
InChIKeySQNVCPUAUAYWRT-UHFFFAOYSA-N
XLogP2.47
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.37
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(4-methylpentan-2-yl)propane-2-sulfinamide?
The IUPAC name of 2-methyl-N-(4-methylpentan-2-yl)propane-2-sulfinamide (CID 73008898) is 2-methyl-N-(4-methylpentan-2-yl)propane-2-sulfinamide.
What is the SMILES notation for 2-methyl-N-(4-methylpentan-2-yl)propane-2-sulfinamide?
The canonical SMILES for 2-methyl-N-(4-methylpentan-2-yl)propane-2-sulfinamide is CC(C)CC(C)NS(=O)C(C)(C)C.
What is the InChIKey of 2-methyl-N-(4-methylpentan-2-yl)propane-2-sulfinamide?
The InChIKey is SQNVCPUAUAYWRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23NOS/c1-8(2)7-9(3)11-13(12)10(4,5)6/h8-9,11H,7H2,1-6H3.
What are the key properties of 2-methyl-N-(4-methylpentan-2-yl)propane-2-sulfinamide?
2-methyl-N-(4-methylpentan-2-yl)propane-2-sulfinamide has a molecular weight of 205.37 g/mol, XLogP of 2.47, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(4-methylpentan-2-yl)propane-2-sulfinamide is sourced from PubChem (CID 73008898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).