(2-methoxycyclobutyl)methanamine

C6H13NO — CID 68694340

IUPAC(2-methoxycyclobutyl)methanamine
SMILESCOC1CCC1CN
InChIInChI=1S/C6H13NO/c1-8-6-3-2-5(6)4-7/h5-6H,2-4,7H2,1H3
InChIKeyWPSNXSHPRYDAHQ-UHFFFAOYSA-N
MW115.18 g/mol
LogP0.37
Rot. Bonds2

About (2-methoxycyclobutyl)methanamine

(2-methoxycyclobutyl)methanamine (PubChem CID 68694340) has the molecular formula C6H13NO and a molecular weight of 115.18 g/mol. Its IUPAC name is (2-methoxycyclobutyl)methanamine.

Molecular Properties

Compound Name(2-methoxycyclobutyl)methanamine
PubChem CID68694340
Molecular FormulaC6H13NO
Molecular Weight115.18 g/mol
Exact Mass115.10
IUPAC Name(2-methoxycyclobutyl)methanamine
SMILESCOC1CCC1CN
InChIInChI=1S/C6H13NO/c1-8-6-3-2-5(6)4-7/h5-6H,2-4,7H2,1H3
InChIKeyWPSNXSHPRYDAHQ-UHFFFAOYSA-N
XLogP0.37
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 ≤ 50.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2-methoxycyclobutyl)methanamine?
The IUPAC name of (2-methoxycyclobutyl)methanamine (CID 68694340) is (2-methoxycyclobutyl)methanamine.
What is the SMILES notation for (2-methoxycyclobutyl)methanamine?
The canonical SMILES for (2-methoxycyclobutyl)methanamine is COC1CCC1CN.
What is the InChIKey of (2-methoxycyclobutyl)methanamine?
The InChIKey is WPSNXSHPRYDAHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO/c1-8-6-3-2-5(6)4-7/h5-6H,2-4,7H2,1H3.
What are the key properties of (2-methoxycyclobutyl)methanamine?
(2-methoxycyclobutyl)methanamine has a molecular weight of 115.18 g/mol, XLogP of 0.37, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methoxycyclobutyl)methanamine is sourced from PubChem (CID 68694340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).