(1-methoxycyclopropyl)methanamine

C5H11NO — CID 83872171

IUPAC(1-methoxycyclopropyl)methanamine
SMILESCOC1(CN)CC1
InChIInChI=1S/C5H11NO/c1-7-5(4-6)2-3-5/h2-4,6H2,1H3
InChIKeyFHZDVWVTFMUBNC-UHFFFAOYSA-N
MW101.15 g/mol
LogP0.12
Rot. Bonds2

About (1-methoxycyclopropyl)methanamine

(1-methoxycyclopropyl)methanamine (PubChem CID 83872171) has the molecular formula C5H11NO and a molecular weight of 101.15 g/mol. Its IUPAC name is (1-methoxycyclopropyl)methanamine.

Molecular Properties

Compound Name(1-methoxycyclopropyl)methanamine
PubChem CID83872171
Molecular FormulaC5H11NO
Molecular Weight101.15 g/mol
Exact Mass101.08
IUPAC Name(1-methoxycyclopropyl)methanamine
SMILESCOC1(CN)CC1
InChIInChI=1S/C5H11NO/c1-7-5(4-6)2-3-5/h2-4,6H2,1H3
InChIKeyFHZDVWVTFMUBNC-UHFFFAOYSA-N
XLogP0.12
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500101.15
LogP ≤ 50.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (1-methoxycyclopropyl)methanamine?
The IUPAC name of (1-methoxycyclopropyl)methanamine (CID 83872171) is (1-methoxycyclopropyl)methanamine.
What is the SMILES notation for (1-methoxycyclopropyl)methanamine?
The canonical SMILES for (1-methoxycyclopropyl)methanamine is COC1(CN)CC1.
What is the InChIKey of (1-methoxycyclopropyl)methanamine?
The InChIKey is FHZDVWVTFMUBNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11NO/c1-7-5(4-6)2-3-5/h2-4,6H2,1H3.
What are the key properties of (1-methoxycyclopropyl)methanamine?
(1-methoxycyclopropyl)methanamine has a molecular weight of 101.15 g/mol, XLogP of 0.12, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1-methoxycyclopropyl)methanamine is sourced from PubChem (CID 83872171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).