2-(2-cyclopropylethoxymethyl)prop-2-en-1-amine

C9H17NO — CID 106203363

IUPAC2-(2-cyclopropylethoxymethyl)prop-2-en-1-amine
SMILESC=C(CN)COCCC1CC1
InChIInChI=1S/C9H17NO/c1-8(6-10)7-11-5-4-9-2-3-9/h9H,1-7,10H2
InChIKeyBPWPHXAZRFHSEM-UHFFFAOYSA-N
MW155.24 g/mol
LogP1.32
Rot. Bonds6

About 2-(2-cyclopropylethoxymethyl)prop-2-en-1-amine

2-(2-cyclopropylethoxymethyl)prop-2-en-1-amine (PubChem CID 106203363) has the molecular formula C9H17NO and a molecular weight of 155.24 g/mol. Its IUPAC name is 2-(2-cyclopropylethoxymethyl)prop-2-en-1-amine.

Molecular Properties

Compound Name2-(2-cyclopropylethoxymethyl)prop-2-en-1-amine
PubChem CID106203363
Molecular FormulaC9H17NO
Molecular Weight155.24 g/mol
Exact Mass155.13
IUPAC Name2-(2-cyclopropylethoxymethyl)prop-2-en-1-amine
SMILESC=C(CN)COCCC1CC1
InChIInChI=1S/C9H17NO/c1-8(6-10)7-11-5-4-9-2-3-9/h9H,1-7,10H2
InChIKeyBPWPHXAZRFHSEM-UHFFFAOYSA-N
XLogP1.32
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.24
LogP ≤ 51.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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

2-(3-Methylbutoxymethyl)prop-2-en-1-amine
CID 103074387
2-(4-Methylpentan-2-yloxymethyl)prop-2-en-1-amine
CID 103074482
2-(4-Methylpentoxymethyl)prop-2-en-1-amine
CID 103074543
2-(Cyclopropylmethoxymethyl)prop-2-en-1-amine
CID 103074582
2-(Pentoxymethyl)prop-2-en-1-amine
CID 103074638
2-(Oxan-4-ylmethoxymethyl)prop-2-en-1-amine
CID 103074741
2-(2-Methylpentoxymethyl)prop-2-en-1-amine
CID 103284481
(E)-4-(2-cyclopropylethoxy)but-2-en-1-amine
CID 106201880
2-(2-cyclopropylethoxymethyl)-N-ethylprop-2-en-1-amine
CID 106203355
2-(2-cyclopropylethoxymethyl)-N-propylprop-2-en-1-amine
CID 106203357
2-(2-cyclopropylethoxymethyl)-N-methylprop-2-en-1-amine
CID 106203359
2-(2-Cyclobutylethoxymethyl)prop-2-en-1-amine
CID 106203377

Frequently Asked Questions

What is the IUPAC name of 2-(2-cyclopropylethoxymethyl)prop-2-en-1-amine?
The IUPAC name of 2-(2-cyclopropylethoxymethyl)prop-2-en-1-amine (CID 106203363) is 2-(2-cyclopropylethoxymethyl)prop-2-en-1-amine.
What is the SMILES notation for 2-(2-cyclopropylethoxymethyl)prop-2-en-1-amine?
The canonical SMILES for 2-(2-cyclopropylethoxymethyl)prop-2-en-1-amine is C=C(CN)COCCC1CC1.
What is the InChIKey of 2-(2-cyclopropylethoxymethyl)prop-2-en-1-amine?
The InChIKey is BPWPHXAZRFHSEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO/c1-8(6-10)7-11-5-4-9-2-3-9/h9H,1-7,10H2.
What are the key properties of 2-(2-cyclopropylethoxymethyl)prop-2-en-1-amine?
2-(2-cyclopropylethoxymethyl)prop-2-en-1-amine has a molecular weight of 155.24 g/mol, XLogP of 1.32, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-cyclopropylethoxymethyl)prop-2-en-1-amine is sourced from PubChem (CID 106203363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).