[1-(propoxymethyl)cyclopropyl]methanamine

C8H17NO — CID 84762802

IUPAC[1-(propoxymethyl)cyclopropyl]methanamine
SMILESCCCOCC1(CN)CC1
InChIInChI=1S/C8H17NO/c1-2-5-10-7-8(6-9)3-4-8/h2-7,9H2,1H3
InChIKeyFWGIBNCYCNQWGC-UHFFFAOYSA-N
MW143.23 g/mol
LogP1.15
Rot. Bonds5

About [1-(propoxymethyl)cyclopropyl]methanamine

[1-(propoxymethyl)cyclopropyl]methanamine (PubChem CID 84762802) has the molecular formula C8H17NO and a molecular weight of 143.23 g/mol. Its IUPAC name is [1-(propoxymethyl)cyclopropyl]methanamine.

Molecular Properties

Compound Name[1-(propoxymethyl)cyclopropyl]methanamine
PubChem CID84762802
Molecular FormulaC8H17NO
Molecular Weight143.23 g/mol
Exact Mass143.13
IUPAC Name[1-(propoxymethyl)cyclopropyl]methanamine
SMILESCCCOCC1(CN)CC1
InChIInChI=1S/C8H17NO/c1-2-5-10-7-8(6-9)3-4-8/h2-7,9H2,1H3
InChIKeyFWGIBNCYCNQWGC-UHFFFAOYSA-N
XLogP1.15
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.23
LogP ≤ 51.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

[1-(2-propoxyethyl)cyclooctyl]methanamine
CID 106459345
N-[[1-(aminomethyl)cyclohexyl]methyl]-2-propoxyacetamide
CID 107941625
(4,4-dimethyl-1-propylcyclohexyl)methanamine
CID 65389394
[4-propan-2-yl-1-(2-propoxyethyl)cyclohexyl]methanamine
CID 106459327
N-[[1-(aminomethyl)cyclopropyl]methyl]-2-ethoxy-N-(2-ethoxyethyl)ethanamine
CID 82954753
1-(bromomethyl)-1-(heptoxymethyl)cyclopropane
CID 65008372
[1-(2-methoxyethoxymethyl)-3-methylcyclobutyl]methanamine
CID 119055116
4-fluoro-4-(propoxymethyl)cyclohexan-1-amine
CID 112562319
[1-(2-ethoxyethyl)cyclopentyl]methanamine
CID 62724287
[1-(2-methylpropoxymethyl)cyclobutyl]methanamine
CID 97033932
4-(propoxymethyl)oxan-4-ol
CID 79568343
[1-(cyclopropyloxymethyl)cyclopropyl]methanamine
CID 84762673

Frequently Asked Questions

What is the IUPAC name of [1-(propoxymethyl)cyclopropyl]methanamine?
The IUPAC name of [1-(propoxymethyl)cyclopropyl]methanamine (CID 84762802) is [1-(propoxymethyl)cyclopropyl]methanamine.
What is the SMILES notation for [1-(propoxymethyl)cyclopropyl]methanamine?
The canonical SMILES for [1-(propoxymethyl)cyclopropyl]methanamine is CCCOCC1(CN)CC1.
What is the InChIKey of [1-(propoxymethyl)cyclopropyl]methanamine?
The InChIKey is FWGIBNCYCNQWGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO/c1-2-5-10-7-8(6-9)3-4-8/h2-7,9H2,1H3.
What are the key properties of [1-(propoxymethyl)cyclopropyl]methanamine?
[1-(propoxymethyl)cyclopropyl]methanamine has a molecular weight of 143.23 g/mol, XLogP of 1.15, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(propoxymethyl)cyclopropyl]methanamine is sourced from PubChem (CID 84762802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).