N,N'-dipropylmethanedisulfonamide

C7H18N2O4S2 — CID 90121590

IUPACN,N'-dipropylmethanedisulfonamide
SMILESCCCNS(=O)(=O)CS(=O)(=O)NCCC
InChIInChI=1S/C7H18N2O4S2/c1-3-5-8-14(10,11)7-15(12,13)9-6-4-2/h8-9H,3-7H2,1-2H3
InChIKeyPGFHZJKAFNDWJQ-UHFFFAOYSA-N
MW258.36 g/mol
LogP-0.40
Rot. Bonds8

About N,N'-dipropylmethanedisulfonamide

N,N'-dipropylmethanedisulfonamide (PubChem CID 90121590) has the molecular formula C7H18N2O4S2 and a molecular weight of 258.36 g/mol. Its IUPAC name is N,N'-dipropylmethanedisulfonamide.

Molecular Properties

Compound NameN,N'-dipropylmethanedisulfonamide
PubChem CID90121590
Molecular FormulaC7H18N2O4S2
Molecular Weight258.36 g/mol
Exact Mass258.07
IUPAC NameN,N'-dipropylmethanedisulfonamide
SMILESCCCNS(=O)(=O)CS(=O)(=O)NCCC
InChIInChI=1S/C7H18N2O4S2/c1-3-5-8-14(10,11)7-15(12,13)9-6-4-2/h8-9H,3-7H2,1-2H3
InChIKeyPGFHZJKAFNDWJQ-UHFFFAOYSA-N
XLogP-0.40
TPSA92.34 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.36
LogP ≤ 5-0.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N,N'-dipropylmethanedisulfonamide?
The IUPAC name of N,N'-dipropylmethanedisulfonamide (CID 90121590) is N,N'-dipropylmethanedisulfonamide.
What is the SMILES notation for N,N'-dipropylmethanedisulfonamide?
The canonical SMILES for N,N'-dipropylmethanedisulfonamide is CCCNS(=O)(=O)CS(=O)(=O)NCCC.
What is the InChIKey of N,N'-dipropylmethanedisulfonamide?
The InChIKey is PGFHZJKAFNDWJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H18N2O4S2/c1-3-5-8-14(10,11)7-15(12,13)9-6-4-2/h8-9H,3-7H2,1-2H3.
What are the key properties of N,N'-dipropylmethanedisulfonamide?
N,N'-dipropylmethanedisulfonamide has a molecular weight of 258.36 g/mol, XLogP of -0.40, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N'-dipropylmethanedisulfonamide is sourced from PubChem (CID 90121590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).