(E)-N-methoxy-2,2-dimethylcyclopentan-1-imine

C8H15NO — CID 135085777

IUPAC(E)-N-methoxy-2,2-dimethylcyclopentan-1-imine
SMILESCO/N=C1\CCCC1(C)C
InChIInChI=1S/C8H15NO/c1-8(2)6-4-5-7(8)9-10-3/h4-6H2,1-3H3/b9-7+
InChIKeyJABQOKFRKBWPLD-VQHVLOKHSA-N
MW141.21 g/mol
LogP2.20
Rot. Bonds1

About (E)-N-methoxy-2,2-dimethylcyclopentan-1-imine

(E)-N-methoxy-2,2-dimethylcyclopentan-1-imine (PubChem CID 135085777) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is (E)-N-methoxy-2,2-dimethylcyclopentan-1-imine.

Molecular Properties

Compound Name(E)-N-methoxy-2,2-dimethylcyclopentan-1-imine
PubChem CID135085777
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC Name(E)-N-methoxy-2,2-dimethylcyclopentan-1-imine
SMILESCO/N=C1\CCCC1(C)C
InChIInChI=1S/C8H15NO/c1-8(2)6-4-5-7(8)9-10-3/h4-6H2,1-3H3/b9-7+
InChIKeyJABQOKFRKBWPLD-VQHVLOKHSA-N
XLogP2.20
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.21
LogP ≤ 52.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (E)-N-methoxy-2,2-dimethylcyclopentan-1-imine?
The IUPAC name of (E)-N-methoxy-2,2-dimethylcyclopentan-1-imine (CID 135085777) is (E)-N-methoxy-2,2-dimethylcyclopentan-1-imine.
What is the SMILES notation for (E)-N-methoxy-2,2-dimethylcyclopentan-1-imine?
The canonical SMILES for (E)-N-methoxy-2,2-dimethylcyclopentan-1-imine is CO/N=C1\CCCC1(C)C.
What is the InChIKey of (E)-N-methoxy-2,2-dimethylcyclopentan-1-imine?
The InChIKey is JABQOKFRKBWPLD-VQHVLOKHSA-N. The full InChI is InChI=1S/C8H15NO/c1-8(2)6-4-5-7(8)9-10-3/h4-6H2,1-3H3/b9-7+.
What are the key properties of (E)-N-methoxy-2,2-dimethylcyclopentan-1-imine?
(E)-N-methoxy-2,2-dimethylcyclopentan-1-imine has a molecular weight of 141.21 g/mol, XLogP of 2.20, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N-methoxy-2,2-dimethylcyclopentan-1-imine is sourced from PubChem (CID 135085777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).