(1-methoxycyclobutyl)methanamine

C6H13NO — CID 66072375

IUPAC(1-methoxycyclobutyl)methanamine
SMILESCOC1(CN)CCC1
InChIInChI=1S/C6H13NO/c1-8-6(5-7)3-2-4-6/h2-5,7H2,1H3
InChIKeyOLARWWJMDKDOIC-UHFFFAOYSA-N
MW115.18 g/mol
LogP0.51
Rot. Bonds2

About (1-methoxycyclobutyl)methanamine

(1-methoxycyclobutyl)methanamine (PubChem CID 66072375) has the molecular formula C6H13NO and a molecular weight of 115.18 g/mol. Its IUPAC name is (1-methoxycyclobutyl)methanamine.

Molecular Properties

Compound Name(1-methoxycyclobutyl)methanamine
PubChem CID66072375
Molecular FormulaC6H13NO
Molecular Weight115.18 g/mol
Exact Mass115.10
IUPAC Name(1-methoxycyclobutyl)methanamine
SMILESCOC1(CN)CCC1
InChIInChI=1S/C6H13NO/c1-8-6(5-7)3-2-4-6/h2-5,7H2,1H3
InChIKeyOLARWWJMDKDOIC-UHFFFAOYSA-N
XLogP0.51
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500115.18
LogP ≤ 50.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (1-methoxycyclobutyl)methanamine?
The IUPAC name of (1-methoxycyclobutyl)methanamine (CID 66072375) is (1-methoxycyclobutyl)methanamine.
What is the SMILES notation for (1-methoxycyclobutyl)methanamine?
The canonical SMILES for (1-methoxycyclobutyl)methanamine is COC1(CN)CCC1.
What is the InChIKey of (1-methoxycyclobutyl)methanamine?
The InChIKey is OLARWWJMDKDOIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO/c1-8-6(5-7)3-2-4-6/h2-5,7H2,1H3.
What are the key properties of (1-methoxycyclobutyl)methanamine?
(1-methoxycyclobutyl)methanamine has a molecular weight of 115.18 g/mol, XLogP of 0.51, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1-methoxycyclobutyl)methanamine is sourced from PubChem (CID 66072375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).