2-prop-2-enoxy-N-(2-prop-2-enoxyethyl)ethanamine

C10H19NO2 — CID 22899057

IUPAC2-prop-2-enoxy-N-(2-prop-2-enoxyethyl)ethanamine
SMILESC=CCOCCNCCOCC=C
InChIInChI=1S/C10H19NO2/c1-3-7-12-9-5-11-6-10-13-8-4-2/h3-4,11H,1-2,5-10H2
InChIKeyUCADRVJHSQKOAU-UHFFFAOYSA-N
MW185.27 g/mol
LogP0.98
Rot. Bonds10

About 2-prop-2-enoxy-N-(2-prop-2-enoxyethyl)ethanamine

2-prop-2-enoxy-N-(2-prop-2-enoxyethyl)ethanamine (PubChem CID 22899057) has the molecular formula C10H19NO2 and a molecular weight of 185.27 g/mol. Its IUPAC name is 2-prop-2-enoxy-N-(2-prop-2-enoxyethyl)ethanamine.

Molecular Properties

Compound Name2-prop-2-enoxy-N-(2-prop-2-enoxyethyl)ethanamine
PubChem CID22899057
Molecular FormulaC10H19NO2
Molecular Weight185.27 g/mol
Exact Mass185.14
IUPAC Name2-prop-2-enoxy-N-(2-prop-2-enoxyethyl)ethanamine
SMILESC=CCOCCNCCOCC=C
InChIInChI=1S/C10H19NO2/c1-3-7-12-9-5-11-6-10-13-8-4-2/h3-4,11H,1-2,5-10H2
InChIKeyUCADRVJHSQKOAU-UHFFFAOYSA-N
XLogP0.98
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 50.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

CID 154803684
CID 154803684
CID 58684300
CID 58684300
CID 62570974
CID 62570974
CID 130501726
CID 130501726
CID 13927842
CID 13927842
CID 22899052
CID 22899052
CID 22899053
CID 22899053
CID 53686082
CID 53686082
CID 53730540
CID 53730540
CID 54095916
CID 54095916
CID 57764963
CID 57764963
CID 57895943
CID 57895943

Frequently Asked Questions

What is the IUPAC name of 2-prop-2-enoxy-N-(2-prop-2-enoxyethyl)ethanamine?
The IUPAC name of 2-prop-2-enoxy-N-(2-prop-2-enoxyethyl)ethanamine (CID 22899057) is 2-prop-2-enoxy-N-(2-prop-2-enoxyethyl)ethanamine.
What is the SMILES notation for 2-prop-2-enoxy-N-(2-prop-2-enoxyethyl)ethanamine?
The canonical SMILES for 2-prop-2-enoxy-N-(2-prop-2-enoxyethyl)ethanamine is C=CCOCCNCCOCC=C.
What is the InChIKey of 2-prop-2-enoxy-N-(2-prop-2-enoxyethyl)ethanamine?
The InChIKey is UCADRVJHSQKOAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO2/c1-3-7-12-9-5-11-6-10-13-8-4-2/h3-4,11H,1-2,5-10H2.
What are the key properties of 2-prop-2-enoxy-N-(2-prop-2-enoxyethyl)ethanamine?
2-prop-2-enoxy-N-(2-prop-2-enoxyethyl)ethanamine has a molecular weight of 185.27 g/mol, XLogP of 0.98, 10 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-prop-2-enoxy-N-(2-prop-2-enoxyethyl)ethanamine is sourced from PubChem (CID 22899057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).