N-[(3-methoxycyclobutyl)methyl]ethanamine

C8H17NO — CID 106824556

IUPACN-[(3-methoxycyclobutyl)methyl]ethanamine
SMILESCCNCC1CC(OC)C1
InChIInChI=1S/C8H17NO/c1-3-9-6-7-4-8(5-7)10-2/h7-9H,3-6H2,1-2H3
InChIKeyXQJXZNXMAQVENP-UHFFFAOYSA-N
MW143.23 g/mol
LogP1.02
Rot. Bonds4

About N-[(3-methoxycyclobutyl)methyl]ethanamine

N-[(3-methoxycyclobutyl)methyl]ethanamine (PubChem CID 106824556) has the molecular formula C8H17NO and a molecular weight of 143.23 g/mol. Its IUPAC name is N-[(3-methoxycyclobutyl)methyl]ethanamine.

Molecular Properties

Compound NameN-[(3-methoxycyclobutyl)methyl]ethanamine
PubChem CID106824556
Molecular FormulaC8H17NO
Molecular Weight143.23 g/mol
Exact Mass143.13
IUPAC NameN-[(3-methoxycyclobutyl)methyl]ethanamine
SMILESCCNCC1CC(OC)C1
InChIInChI=1S/C8H17NO/c1-3-9-6-7-4-8(5-7)10-2/h7-9H,3-6H2,1-2H3
InChIKeyXQJXZNXMAQVENP-UHFFFAOYSA-N
XLogP1.02
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.23
LogP ≤ 51.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[(3-methoxycyclobutyl)methyl]ethanamine?
The IUPAC name of N-[(3-methoxycyclobutyl)methyl]ethanamine (CID 106824556) is N-[(3-methoxycyclobutyl)methyl]ethanamine.
What is the SMILES notation for N-[(3-methoxycyclobutyl)methyl]ethanamine?
The canonical SMILES for N-[(3-methoxycyclobutyl)methyl]ethanamine is CCNCC1CC(OC)C1.
What is the InChIKey of N-[(3-methoxycyclobutyl)methyl]ethanamine?
The InChIKey is XQJXZNXMAQVENP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO/c1-3-9-6-7-4-8(5-7)10-2/h7-9H,3-6H2,1-2H3.
What are the key properties of N-[(3-methoxycyclobutyl)methyl]ethanamine?
N-[(3-methoxycyclobutyl)methyl]ethanamine has a molecular weight of 143.23 g/mol, XLogP of 1.02, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-methoxycyclobutyl)methyl]ethanamine is sourced from PubChem (CID 106824556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).