N-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxypropoxy)propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propyl]-2-methylprop-2-enamide

C32H63NO10 — CID 175714960

IUPACN-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxypropoxy)propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propyl]-2-methylprop-2-enamide
SMILESC=C(C)C(=O)NCC(C)OCC(C)OCC(C)OCC(C)OCC(C)OCC(C)OCC(C)OCC(C)OCC(C)OC
InChIInChI=1S/C32H63NO10/c1-22(2)32(34)33-13-23(3)36-15-25(5)38-17-27(7)40-19-29(9)42-21-31(11)43-20-30(10)41-18-28(8)39-16-26(6)37-14-24(4)35-12/h23-31H,1,13-21H2,2-12H3,(H,33,34)
InChIKeyOJFLOFQNGMIZFG-UHFFFAOYSA-N
MW621.85 g/mol
LogP3.95
Rot. Bonds28

About N-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxypropoxy)propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propyl]-2-methylprop-2-enamide

N-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxypropoxy)propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propyl]-2-methylprop-2-enamide (PubChem CID 175714960) has the molecular formula C32H63NO10 and a molecular weight of 621.85 g/mol. Its IUPAC name is N-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxypropoxy)propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propyl]-2-methylprop-2-enamide.

Molecular Properties

Compound NameN-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxypropoxy)propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propyl]-2-methylprop-2-enamide
PubChem CID175714960
Molecular FormulaC32H63NO10
Molecular Weight621.85 g/mol
Exact Mass621.45
IUPAC NameN-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxypropoxy)propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propyl]-2-methylprop-2-enamide
SMILESC=C(C)C(=O)NCC(C)OCC(C)OCC(C)OCC(C)OCC(C)OCC(C)OCC(C)OCC(C)OCC(C)OC
InChIInChI=1S/C32H63NO10/c1-22(2)32(34)33-13-23(3)36-15-25(5)38-17-27(7)40-19-29(9)42-21-31(11)43-20-30(10)41-18-28(8)39-16-26(6)37-14-24(4)35-12/h23-31H,1,13-21H2,2-12H3,(H,33,34)
InChIKeyOJFLOFQNGMIZFG-UHFFFAOYSA-N
XLogP3.95
TPSA112.17 Ų
H-Bond Donors1
H-Bond Acceptors10
Rotatable Bonds28
Heavy Atoms43
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500621.85
LogP ≤ 53.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1010

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Analyze N-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxypropoxy)propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propyl]-2-methylprop-2-enamide with MolForge

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Related Compounds

2-methyl-N-[2-methyl-3-[3-methyl-4-[1-(2-methylprop-2-enoylamino)propan-2-yloxy]butan-2-yl]oxypropyl]prop-2-enamide
CID 139442661
N-(2-methoxypropyl)-2-oxopropanamide
CID 20671651
N-[2-[3-(2,6-dimethyl-5-oxohept-6-enoxy)-2-methylbutoxy]propyl]-2-methylprop-2-enamide
CID 158917743
N-(2-hydroxypropyl)-2-methylprop-2-enamide
CID 159380399
2-methyl-N-[2-methyl-3-[2-[2-methyl-3-(2-methylprop-2-enoylamino)propoxy]ethoxy]propyl]prop-2-enamide
CID 129238388
bis[2-(2-methoxypropoxy)propyl] carbonate
CID 139751195
hydron;N-(2-hydroxypropyl)-2-methylprop-2-enamide
CID 87755917
N-(2-methoxypropyl)acetamide
CID 90876780
1-[1-[1-[1-[1-[1-[1-[1-(1-methoxypropan-2-yloxy)propan-2-yloxy]propan-2-yloxy]propan-2-yloxy]propan-2-yloxy]propan-2-yloxy]propan-2-yloxy]propan-2-yloxy]propan-2-yl 2-methylprop-2-enoate
CID 22918055
[2-methyl-3-(2-methylprop-2-enoylamino)propyl] methanesulfonate
CID 87327562
acetic acid;2-methoxy-1-propan-2-yloxypropane
CID 172787962
1-(2-methylprop-2-enoylamino)propan-2-yl benzoate
CID 152756749

Frequently Asked Questions

What is the IUPAC name of N-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxypropoxy)propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propyl]-2-methylprop-2-enamide?
The IUPAC name of N-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxypropoxy)propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propyl]-2-methylprop-2-enamide (CID 175714960) is N-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxypropoxy)propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propyl]-2-methylprop-2-enamide.
What is the SMILES notation for N-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxypropoxy)propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propyl]-2-methylprop-2-enamide?
The canonical SMILES for N-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxypropoxy)propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propyl]-2-methylprop-2-enamide is C=C(C)C(=O)NCC(C)OCC(C)OCC(C)OCC(C)OCC(C)OCC(C)OCC(C)OCC(C)OCC(C)OC.
What is the InChIKey of N-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxypropoxy)propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propyl]-2-methylprop-2-enamide?
The InChIKey is OJFLOFQNGMIZFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H63NO10/c1-22(2)32(34)33-13-23(3)36-15-25(5)38-17-27(7)40-19-29(9)42-21-31(11)43-20-30(10)41-18-28(8)39-16-26(6)37-14-24(4)35-12/h23-31H,1,13-21H2,2-12H3,(H,33,34).
What are the key properties of N-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxypropoxy)propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propyl]-2-methylprop-2-enamide?
N-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxypropoxy)propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propyl]-2-methylprop-2-enamide has a molecular weight of 621.85 g/mol, XLogP of 3.95, 28 rotatable bonds, 1 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxypropoxy)propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propyl]-2-methylprop-2-enamide is sourced from PubChem (CID 175714960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).