(1-methoxy-3,3-dimethylcyclobutyl)methanamine

C8H17NO — CID 127007242

IUPAC(1-methoxy-3,3-dimethylcyclobutyl)methanamine
SMILESCOC1(CN)CC(C)(C)C1
InChIInChI=1S/C8H17NO/c1-7(2)4-8(5-7,6-9)10-3/h4-6,9H2,1-3H3
InChIKeyIAWOWKWVXQYWIK-UHFFFAOYSA-N
MW143.23 g/mol
LogP1.15
Rot. Bonds2

About (1-methoxy-3,3-dimethylcyclobutyl)methanamine

(1-methoxy-3,3-dimethylcyclobutyl)methanamine (PubChem CID 127007242) has the molecular formula C8H17NO and a molecular weight of 143.23 g/mol. Its IUPAC name is (1-methoxy-3,3-dimethylcyclobutyl)methanamine.

Molecular Properties

Compound Name(1-methoxy-3,3-dimethylcyclobutyl)methanamine
PubChem CID127007242
Molecular FormulaC8H17NO
Molecular Weight143.23 g/mol
Exact Mass143.13
IUPAC Name(1-methoxy-3,3-dimethylcyclobutyl)methanamine
SMILESCOC1(CN)CC(C)(C)C1
InChIInChI=1S/C8H17NO/c1-7(2)4-8(5-7,6-9)10-3/h4-6,9H2,1-3H3
InChIKeyIAWOWKWVXQYWIK-UHFFFAOYSA-N
XLogP1.15
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
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

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Frequently Asked Questions

What is the IUPAC name of (1-methoxy-3,3-dimethylcyclobutyl)methanamine?
The IUPAC name of (1-methoxy-3,3-dimethylcyclobutyl)methanamine (CID 127007242) is (1-methoxy-3,3-dimethylcyclobutyl)methanamine.
What is the SMILES notation for (1-methoxy-3,3-dimethylcyclobutyl)methanamine?
The canonical SMILES for (1-methoxy-3,3-dimethylcyclobutyl)methanamine is COC1(CN)CC(C)(C)C1.
What is the InChIKey of (1-methoxy-3,3-dimethylcyclobutyl)methanamine?
The InChIKey is IAWOWKWVXQYWIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO/c1-7(2)4-8(5-7,6-9)10-3/h4-6,9H2,1-3H3.
What are the key properties of (1-methoxy-3,3-dimethylcyclobutyl)methanamine?
(1-methoxy-3,3-dimethylcyclobutyl)methanamine has a molecular weight of 143.23 g/mol, XLogP of 1.15, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1-methoxy-3,3-dimethylcyclobutyl)methanamine is sourced from PubChem (CID 127007242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).