N-[2-(2-methoxyethoxymethyl)prop-2-enyl]cyclopropanamine

C10H19NO2 — CID 103074416

IUPACN-[2-(2-methoxyethoxymethyl)prop-2-enyl]cyclopropanamine
SMILESC=C(CNC1CC1)COCCOC
InChIInChI=1S/C10H19NO2/c1-9(7-11-10-3-4-10)8-13-6-5-12-2/h10-11H,1,3-8H2,2H3
InChIKeyOFMLGVUGHDNUPS-UHFFFAOYSA-N
MW185.27 g/mol
LogP0.96
Rot. Bonds8

About N-[2-(2-methoxyethoxymethyl)prop-2-enyl]cyclopropanamine

N-[2-(2-methoxyethoxymethyl)prop-2-enyl]cyclopropanamine (PubChem CID 103074416) has the molecular formula C10H19NO2 and a molecular weight of 185.27 g/mol. Its IUPAC name is N-[2-(2-methoxyethoxymethyl)prop-2-enyl]cyclopropanamine.

Molecular Properties

Compound NameN-[2-(2-methoxyethoxymethyl)prop-2-enyl]cyclopropanamine
PubChem CID103074416
Molecular FormulaC10H19NO2
Molecular Weight185.27 g/mol
Exact Mass185.14
IUPAC NameN-[2-(2-methoxyethoxymethyl)prop-2-enyl]cyclopropanamine
SMILESC=C(CNC1CC1)COCCOC
InChIInChI=1S/C10H19NO2/c1-9(7-11-10-3-4-10)8-13-6-5-12-2/h10-11H,1,3-8H2,2H3
InChIKeyOFMLGVUGHDNUPS-UHFFFAOYSA-N
XLogP0.96
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 50.96
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

N-[2-(butoxymethyl)prop-2-enyl]cyclopropanamine
CID 103074641
N-[2-[(3-methoxy-3-methylbutoxy)methyl]prop-2-enyl]cyclopropanamine
CID 106666324
N-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]cyclopropanamine
CID 104560665
N-cyclopropyl-N'-(2-methoxyethyl)-2-methylidene-N'-(2-methylpropyl)propane-1,3-diamine
CID 103069901
3-[2-[(cyclopropylamino)methyl]prop-2-enyl-(2-methoxyethyl)amino]propanenitrile
CID 103070598
N-butan-2-yl-N'-cyclopropyl-N-(2-methoxyethyl)-2-methylidenepropane-1,3-diamine
CID 103070042
N-[2-[(4-methoxyphenoxy)methyl]prop-2-enyl]cyclopropanamine
CID 103066708
N-[2-[(3-methoxycyclohexyl)oxymethyl]prop-2-enyl]cyclopropanamine
CID 103074784
2-(chloromethyl)-3-(2-methoxyethoxy)prop-1-ene
CID 10888272
2-[2-(2-methoxyethoxy)ethoxy]ethyl 2-(cyclopentylamino)acetate
CID 104563132
N-[3-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-2-methylpropyl]cyclopropanamine
CID 103075099
N-[2-(1,1,1,3,3,3-hexafluoropropan-2-yloxymethyl)prop-2-enyl]cyclopropanamine
CID 103075210

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-methoxyethoxymethyl)prop-2-enyl]cyclopropanamine?
The IUPAC name of N-[2-(2-methoxyethoxymethyl)prop-2-enyl]cyclopropanamine (CID 103074416) is N-[2-(2-methoxyethoxymethyl)prop-2-enyl]cyclopropanamine.
What is the SMILES notation for N-[2-(2-methoxyethoxymethyl)prop-2-enyl]cyclopropanamine?
The canonical SMILES for N-[2-(2-methoxyethoxymethyl)prop-2-enyl]cyclopropanamine is C=C(CNC1CC1)COCCOC.
What is the InChIKey of N-[2-(2-methoxyethoxymethyl)prop-2-enyl]cyclopropanamine?
The InChIKey is OFMLGVUGHDNUPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO2/c1-9(7-11-10-3-4-10)8-13-6-5-12-2/h10-11H,1,3-8H2,2H3.
What are the key properties of N-[2-(2-methoxyethoxymethyl)prop-2-enyl]cyclopropanamine?
N-[2-(2-methoxyethoxymethyl)prop-2-enyl]cyclopropanamine has a molecular weight of 185.27 g/mol, XLogP of 0.96, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-methoxyethoxymethyl)prop-2-enyl]cyclopropanamine is sourced from PubChem (CID 103074416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).