N-(2-ethoxyethyl)-N-propylformamide

C8H17NO2 — CID 88769862

IUPACN-(2-ethoxyethyl)-N-propylformamide
SMILESCCCN(C=O)CCOCC
InChIInChI=1S/C8H17NO2/c1-3-5-9(8-10)6-7-11-4-2/h8H,3-7H2,1-2H3
InChIKeyBYSIFQCFRDWLOK-UHFFFAOYSA-N
MW159.23 g/mol
LogP0.89
Rot. Bonds7

About N-(2-ethoxyethyl)-N-propylformamide

N-(2-ethoxyethyl)-N-propylformamide (PubChem CID 88769862) has the molecular formula C8H17NO2 and a molecular weight of 159.23 g/mol. Its IUPAC name is N-(2-ethoxyethyl)-N-propylformamide.

Molecular Properties

Compound NameN-(2-ethoxyethyl)-N-propylformamide
PubChem CID88769862
Molecular FormulaC8H17NO2
Molecular Weight159.23 g/mol
Exact Mass159.13
IUPAC NameN-(2-ethoxyethyl)-N-propylformamide
SMILESCCCN(C=O)CCOCC
InChIInChI=1S/C8H17NO2/c1-3-5-9(8-10)6-7-11-4-2/h8H,3-7H2,1-2H3
InChIKeyBYSIFQCFRDWLOK-UHFFFAOYSA-N
XLogP0.89
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.23
LogP ≤ 50.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

Acetamide, N-(ethoxyethyl)-N-ethyl-
CID 50628
Acetamide, N-(2-butoxyethyl)-N-ethyl-
CID 3050601
N,N-bis(2-methoxyethyl)formamide
CID 14292517
N,N-bis(1-ethoxypropyl)formamide
CID 10488971
N,N-bis(1-ethoxy-2-methylpropyl)formamide
CID 10800407
2-ethoxy-N,N-dipropylacetamide
CID 4102599
N-(2-ethoxyethyl)-N,2-dimethylpropanamide
CID 11423854
N-butyl-N-(2-methoxyethyl)carbamoyl chloride
CID 12238062
N-(2-ethoxyethyl)-N-propylcarbamoyl chloride
CID 12238066
N-butyl-N-(2-ethoxyethyl)carbamoyl chloride
CID 12238067
N-ethyl-N-(2-propoxyethyl)carbamoyl chloride
CID 12238073
N-ethyl-N-(2-propoxyethyl)acetamide
CID 18684109

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxyethyl)-N-propylformamide?
The IUPAC name of N-(2-ethoxyethyl)-N-propylformamide (CID 88769862) is N-(2-ethoxyethyl)-N-propylformamide.
What is the SMILES notation for N-(2-ethoxyethyl)-N-propylformamide?
The canonical SMILES for N-(2-ethoxyethyl)-N-propylformamide is CCCN(C=O)CCOCC.
What is the InChIKey of N-(2-ethoxyethyl)-N-propylformamide?
The InChIKey is BYSIFQCFRDWLOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO2/c1-3-5-9(8-10)6-7-11-4-2/h8H,3-7H2,1-2H3.
What are the key properties of N-(2-ethoxyethyl)-N-propylformamide?
N-(2-ethoxyethyl)-N-propylformamide has a molecular weight of 159.23 g/mol, XLogP of 0.89, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxyethyl)-N-propylformamide is sourced from PubChem (CID 88769862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).