molecular hydrogen;N-propan-2-yl-2-[2-[2-[2-[2-(propan-2-ylamino)ethoxy]ethoxy]ethoxy]ethoxy]acetamide

C16H38N2O5 — CID 157048845

IUPACmolecular hydrogen;N-propan-2-yl-2-[2-[2-[2-[2-(propan-2-ylamino)ethoxy]ethoxy]ethoxy]ethoxy]acetamide
SMILESCC(C)NCCOCCOCCOCCOCC(=O)NC(C)C.[H][H].[H][H]
InChIInChI=1S/C16H34N2O5.2H2/c1-14(2)17-5-6-20-7-8-21-9-10-22-11-12-23-13-16(19)18-15(3)4;;/h14-15,17H,5-13H2,1-4H3,(H,18,19);2*1H
InChIKeyOCXHNXXNVNSDAG-UHFFFAOYSA-N
MW338.49 g/mol
LogP1.07
Rot. Bonds16

About molecular hydrogen;N-propan-2-yl-2-[2-[2-[2-[2-(propan-2-ylamino)ethoxy]ethoxy]ethoxy]ethoxy]acetamide

molecular hydrogen;N-propan-2-yl-2-[2-[2-[2-[2-(propan-2-ylamino)ethoxy]ethoxy]ethoxy]ethoxy]acetamide (PubChem CID 157048845) has the molecular formula C16H38N2O5 and a molecular weight of 338.49 g/mol. Its IUPAC name is molecular hydrogen;N-propan-2-yl-2-[2-[2-[2-[2-(propan-2-ylamino)ethoxy]ethoxy]ethoxy]ethoxy]acetamide.

Molecular Properties

Compound Namemolecular hydrogen;N-propan-2-yl-2-[2-[2-[2-[2-(propan-2-ylamino)ethoxy]ethoxy]ethoxy]ethoxy]acetamide
PubChem CID157048845
Molecular FormulaC16H38N2O5
Molecular Weight338.49 g/mol
Exact Mass338.28
IUPAC Namemolecular hydrogen;N-propan-2-yl-2-[2-[2-[2-[2-(propan-2-ylamino)ethoxy]ethoxy]ethoxy]ethoxy]acetamide
SMILESCC(C)NCCOCCOCCOCCOCC(=O)NC(C)C.[H][H].[H][H]
InChIInChI=1S/C16H34N2O5.2H2/c1-14(2)17-5-6-20-7-8-21-9-10-22-11-12-23-13-16(19)18-15(3)4;;/h14-15,17H,5-13H2,1-4H3,(H,18,19);2*1H
InChIKeyOCXHNXXNVNSDAG-UHFFFAOYSA-N
XLogP1.07
TPSA78.05 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds16
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.49
LogP ≤ 51.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of molecular hydrogen;N-propan-2-yl-2-[2-[2-[2-[2-(propan-2-ylamino)ethoxy]ethoxy]ethoxy]ethoxy]acetamide?
The IUPAC name of molecular hydrogen;N-propan-2-yl-2-[2-[2-[2-[2-(propan-2-ylamino)ethoxy]ethoxy]ethoxy]ethoxy]acetamide (CID 157048845) is molecular hydrogen;N-propan-2-yl-2-[2-[2-[2-[2-(propan-2-ylamino)ethoxy]ethoxy]ethoxy]ethoxy]acetamide.
What is the SMILES notation for molecular hydrogen;N-propan-2-yl-2-[2-[2-[2-[2-(propan-2-ylamino)ethoxy]ethoxy]ethoxy]ethoxy]acetamide?
The canonical SMILES for molecular hydrogen;N-propan-2-yl-2-[2-[2-[2-[2-(propan-2-ylamino)ethoxy]ethoxy]ethoxy]ethoxy]acetamide is CC(C)NCCOCCOCCOCCOCC(=O)NC(C)C.[H][H].[H][H].
What is the InChIKey of molecular hydrogen;N-propan-2-yl-2-[2-[2-[2-[2-(propan-2-ylamino)ethoxy]ethoxy]ethoxy]ethoxy]acetamide?
The InChIKey is OCXHNXXNVNSDAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34N2O5.2H2/c1-14(2)17-5-6-20-7-8-21-9-10-22-11-12-23-13-16(19)18-15(3)4;;/h14-15,17H,5-13H2,1-4H3,(H,18,19);2*1H.
What are the key properties of molecular hydrogen;N-propan-2-yl-2-[2-[2-[2-[2-(propan-2-ylamino)ethoxy]ethoxy]ethoxy]ethoxy]acetamide?
molecular hydrogen;N-propan-2-yl-2-[2-[2-[2-[2-(propan-2-ylamino)ethoxy]ethoxy]ethoxy]ethoxy]acetamide has a molecular weight of 338.49 g/mol, XLogP of 1.07, 16 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for molecular hydrogen;N-propan-2-yl-2-[2-[2-[2-[2-(propan-2-ylamino)ethoxy]ethoxy]ethoxy]ethoxy]acetamide is sourced from PubChem (CID 157048845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).