formaldehyde;N-[3-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]propyl]-N-methyloctadecan-1-amine

C34H71NO7 — CID 161166009

IUPACformaldehyde;N-[3-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]propyl]-N-methyloctadecan-1-amine
SMILESC=O.CCCCCCCCCCCCCCCCCCN(C)CCCOCCOCCOCCOCCOCCOC
InChIInChI=1S/C33H69NO6.CH2O/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21-34(2)22-20-23-36-26-27-38-30-31-40-33-32-39-29-28-37-25-24-35-3;1-2/h4-33H2,1-3H3;1H2
InChIKeyUQNVMESNIQQZLA-UHFFFAOYSA-N
MW605.94 g/mol
LogP7.11
Rot. Bonds36

About formaldehyde;N-[3-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]propyl]-N-methyloctadecan-1-amine

formaldehyde;N-[3-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]propyl]-N-methyloctadecan-1-amine (PubChem CID 161166009) has the molecular formula C34H71NO7 and a molecular weight of 605.94 g/mol. Its IUPAC name is formaldehyde;N-[3-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]propyl]-N-methyloctadecan-1-amine.

Molecular Properties

Compound Nameformaldehyde;N-[3-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]propyl]-N-methyloctadecan-1-amine
PubChem CID161166009
Molecular FormulaC34H71NO7
Molecular Weight605.94 g/mol
Exact Mass605.52
IUPAC Nameformaldehyde;N-[3-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]propyl]-N-methyloctadecan-1-amine
SMILESC=O.CCCCCCCCCCCCCCCCCCN(C)CCCOCCOCCOCCOCCOCCOC
InChIInChI=1S/C33H69NO6.CH2O/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21-34(2)22-20-23-36-26-27-38-30-31-40-33-32-39-29-28-37-25-24-35-3;1-2/h4-33H2,1-3H3;1H2
InChIKeyUQNVMESNIQQZLA-UHFFFAOYSA-N
XLogP7.11
TPSA75.69 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds36
Heavy Atoms42
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500605.94
LogP ≤ 57.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

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

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Related Compounds

N-(3-methoxypropyl)-N-methylpentan-1-amine
CID 143723134
N-[2-[3-(2-methoxyethoxy)propoxy]ethyl]-N-methylbutan-1-amine
CID 156867947
3-hexoxy-N-methyl-N-propylpropan-1-amine
CID 155459820
1-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]tetradecane
CID 102000806
1-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]heptane
CID 44593867
1-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]octane
CID 175220502
1-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]octane
CID 151811497
1,2-dimethoxyethane;1-hexoxyhexane
CID 174800290
N-[2-[2-[2-[di(undecyl)amino]ethoxy]ethoxy]ethyl]-N-methylundecan-1-amine
CID 171750134
ethane;N-[2-(3-methoxypropoxy)ethyl]-N-methylbutan-1-amine
CID 166148269
1-[2-(2-butoxyethoxy)ethoxy]butane;1-[2-(2-methoxyethoxy)ethoxy]pentane
CID 157339506
N,N'-dimethyl-N-pentyl-N'-[2-(2-propoxyethoxy)ethyl]ethane-1,2-diamine
CID 167513119

Frequently Asked Questions

What is the IUPAC name of formaldehyde;N-[3-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]propyl]-N-methyloctadecan-1-amine?
The IUPAC name of formaldehyde;N-[3-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]propyl]-N-methyloctadecan-1-amine (CID 161166009) is formaldehyde;N-[3-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]propyl]-N-methyloctadecan-1-amine.
What is the SMILES notation for formaldehyde;N-[3-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]propyl]-N-methyloctadecan-1-amine?
The canonical SMILES for formaldehyde;N-[3-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]propyl]-N-methyloctadecan-1-amine is C=O.CCCCCCCCCCCCCCCCCCN(C)CCCOCCOCCOCCOCCOCCOC.
What is the InChIKey of formaldehyde;N-[3-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]propyl]-N-methyloctadecan-1-amine?
The InChIKey is UQNVMESNIQQZLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H69NO6.CH2O/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21-34(2)22-20-23-36-26-27-38-30-31-40-33-32-39-29-28-37-25-24-35-3;1-2/h4-33H2,1-3H3;1H2.
What are the key properties of formaldehyde;N-[3-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]propyl]-N-methyloctadecan-1-amine?
formaldehyde;N-[3-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]propyl]-N-methyloctadecan-1-amine has a molecular weight of 605.94 g/mol, XLogP of 7.11, 36 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for formaldehyde;N-[3-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]propyl]-N-methyloctadecan-1-amine is sourced from PubChem (CID 161166009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).