2-methyl-N-propylpropane-1-sulfinamide

C7H17NOS — CID 121353538

IUPAC2-methyl-N-propylpropane-1-sulfinamide
SMILESCCCNS(=O)CC(C)C
InChIInChI=1S/C7H17NOS/c1-4-5-8-10(9)6-7(2)3/h7-8H,4-6H2,1-3H3
InChIKeyOHGMHNLETBYQPD-UHFFFAOYSA-N
MW163.29 g/mol
LogP1.31
Rot. Bonds5

About 2-methyl-N-propylpropane-1-sulfinamide

2-methyl-N-propylpropane-1-sulfinamide (PubChem CID 121353538) has the molecular formula C7H17NOS and a molecular weight of 163.29 g/mol. Its IUPAC name is 2-methyl-N-propylpropane-1-sulfinamide.

Molecular Properties

Compound Name2-methyl-N-propylpropane-1-sulfinamide
PubChem CID121353538
Molecular FormulaC7H17NOS
Molecular Weight163.29 g/mol
Exact Mass163.10
IUPAC Name2-methyl-N-propylpropane-1-sulfinamide
SMILESCCCNS(=O)CC(C)C
InChIInChI=1S/C7H17NOS/c1-4-5-8-10(9)6-7(2)3/h7-8H,4-6H2,1-3H3
InChIKeyOHGMHNLETBYQPD-UHFFFAOYSA-N
XLogP1.31
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.29
LogP ≤ 51.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-isobutylmethanesulfinamide
CID 72437066
n-butyl-N-n-propylsulfonamide
CID 19681138
2-methyl-N-propylpropane-2-sulfinamide
CID 86229710
(R)-N-ethylhexane-1-sulfinamide
CID 163676381
2-methyl-N-(2-methylpropyl)propane-2-sulfinamide
CID 149151884
N-(2-methylpropyl)methanesulinamide
CID 169492063
n-Butylethanesulfinamide
CID 546320
N-(3-methylbutyl)ethanesulfonamide
CID 3401117
N-(2-methylpropyl)ethanesulfonamide
CID 5159392
2-amino-N-(2-methylpropyl)ethanesulfonamide
CID 16782565
2-methyl-N-propylsulfanylpropan-1-amine
CID 18006399
N-(2-methylpropyl)propane-2-sulfonamide
CID 18343504

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-propylpropane-1-sulfinamide?
The IUPAC name of 2-methyl-N-propylpropane-1-sulfinamide (CID 121353538) is 2-methyl-N-propylpropane-1-sulfinamide.
What is the SMILES notation for 2-methyl-N-propylpropane-1-sulfinamide?
The canonical SMILES for 2-methyl-N-propylpropane-1-sulfinamide is CCCNS(=O)CC(C)C.
What is the InChIKey of 2-methyl-N-propylpropane-1-sulfinamide?
The InChIKey is OHGMHNLETBYQPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H17NOS/c1-4-5-8-10(9)6-7(2)3/h7-8H,4-6H2,1-3H3.
What are the key properties of 2-methyl-N-propylpropane-1-sulfinamide?
2-methyl-N-propylpropane-1-sulfinamide has a molecular weight of 163.29 g/mol, XLogP of 1.31, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-propylpropane-1-sulfinamide is sourced from PubChem (CID 121353538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).