N-[2-[2-[2-[2-[2-(propan-2-ylamino)ethoxy]ethoxy]ethoxy]ethoxy]ethyl]methanesulfonamide

C14H32N2O6S — CID 170639490

IUPACN-[2-[2-[2-[2-[2-(propan-2-ylamino)ethoxy]ethoxy]ethoxy]ethoxy]ethyl]methanesulfonamide
SMILESCC(C)NCCOCCOCCOCCOCCNS(C)(=O)=O
InChIInChI=1S/C14H32N2O6S/c1-14(2)15-4-6-19-8-10-21-12-13-22-11-9-20-7-5-16-23(3,17)18/h14-16H,4-13H2,1-3H3
InChIKeyKEPQYYBGKIGAND-UHFFFAOYSA-N
MW356.49 g/mol
LogP-0.40
Rot. Bonds17

About N-[2-[2-[2-[2-[2-(propan-2-ylamino)ethoxy]ethoxy]ethoxy]ethoxy]ethyl]methanesulfonamide

N-[2-[2-[2-[2-[2-(propan-2-ylamino)ethoxy]ethoxy]ethoxy]ethoxy]ethyl]methanesulfonamide (PubChem CID 170639490) has the molecular formula C14H32N2O6S and a molecular weight of 356.49 g/mol. Its IUPAC name is N-[2-[2-[2-[2-[2-(propan-2-ylamino)ethoxy]ethoxy]ethoxy]ethoxy]ethyl]methanesulfonamide.

Molecular Properties

Compound NameN-[2-[2-[2-[2-[2-(propan-2-ylamino)ethoxy]ethoxy]ethoxy]ethoxy]ethyl]methanesulfonamide
PubChem CID170639490
Molecular FormulaC14H32N2O6S
Molecular Weight356.49 g/mol
Exact Mass356.20
IUPAC NameN-[2-[2-[2-[2-[2-(propan-2-ylamino)ethoxy]ethoxy]ethoxy]ethoxy]ethyl]methanesulfonamide
SMILESCC(C)NCCOCCOCCOCCOCCNS(C)(=O)=O
InChIInChI=1S/C14H32N2O6S/c1-14(2)15-4-6-19-8-10-21-12-13-22-11-9-20-7-5-16-23(3,17)18/h14-16H,4-13H2,1-3H3
InChIKeyKEPQYYBGKIGAND-UHFFFAOYSA-N
XLogP-0.40
TPSA95.12 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds17
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.49
LogP ≤ 5-0.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[2-(2-ethoxyethoxy)ethyl]methanesulfonamide
CID 176560121
3-methylsulfonyl-N-[2-[2-[2-[2-(propan-2-ylamino)ethoxy]ethoxy]ethoxy]ethyl]propan-1-amine
CID 178004453
3-methylsulfonyl-N-[2-[2-[2-[2-(propan-2-ylamino)ethoxy]ethoxy]ethoxy]ethyl]propan-1-amine;molecular hydrogen
CID 178004452
N-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethyl]propan-2-amine
CID 138744855
ethane;2-[2-[2-(propan-2-ylamino)ethoxy]ethoxy]acetaldehyde
CID 171646622
1-[2-[2-[2-(propan-2-ylamino)ethoxy]ethoxy]ethoxy]propan-2-one
CID 138727906
2-methyl-N-[2-[2-[2-[2-[2-(propan-2-ylamino)ethoxy]ethoxy]ethoxy]ethoxy]ethyl]propanamide
CID 138727258
2-methyl-N-[2-[2-[2-[2-[2-[2-(propan-2-ylamino)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]propanamide
CID 138727326
2-[2-(propan-2-ylamino)ethoxy]ethyl acetate
CID 172574123
N-[2-[2-[2-(propan-2-ylamino)ethoxy]ethoxy]ethyl]acetamide
CID 153390666
N-[2-[3-[2-(propan-2-ylamino)ethoxy]-2,2-bis[2-(propan-2-ylamino)ethoxymethyl]propoxy]ethyl]propan-2-amine
CID 140945350
N-[2-[2-(3-methylbutoxy)ethoxy]ethyl]propan-2-amine;molecular hydrogen
CID 171507882

Frequently Asked Questions

What is the IUPAC name of N-[2-[2-[2-[2-[2-(propan-2-ylamino)ethoxy]ethoxy]ethoxy]ethoxy]ethyl]methanesulfonamide?
The IUPAC name of N-[2-[2-[2-[2-[2-(propan-2-ylamino)ethoxy]ethoxy]ethoxy]ethoxy]ethyl]methanesulfonamide (CID 170639490) is N-[2-[2-[2-[2-[2-(propan-2-ylamino)ethoxy]ethoxy]ethoxy]ethoxy]ethyl]methanesulfonamide.
What is the SMILES notation for N-[2-[2-[2-[2-[2-(propan-2-ylamino)ethoxy]ethoxy]ethoxy]ethoxy]ethyl]methanesulfonamide?
The canonical SMILES for N-[2-[2-[2-[2-[2-(propan-2-ylamino)ethoxy]ethoxy]ethoxy]ethoxy]ethyl]methanesulfonamide is CC(C)NCCOCCOCCOCCOCCNS(C)(=O)=O.
What is the InChIKey of N-[2-[2-[2-[2-[2-(propan-2-ylamino)ethoxy]ethoxy]ethoxy]ethoxy]ethyl]methanesulfonamide?
The InChIKey is KEPQYYBGKIGAND-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H32N2O6S/c1-14(2)15-4-6-19-8-10-21-12-13-22-11-9-20-7-5-16-23(3,17)18/h14-16H,4-13H2,1-3H3.
What are the key properties of N-[2-[2-[2-[2-[2-(propan-2-ylamino)ethoxy]ethoxy]ethoxy]ethoxy]ethyl]methanesulfonamide?
N-[2-[2-[2-[2-[2-(propan-2-ylamino)ethoxy]ethoxy]ethoxy]ethoxy]ethyl]methanesulfonamide has a molecular weight of 356.49 g/mol, XLogP of -0.40, 17 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-[2-[2-[2-(propan-2-ylamino)ethoxy]ethoxy]ethoxy]ethoxy]ethyl]methanesulfonamide is sourced from PubChem (CID 170639490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).