1-(1-ethenylcyclopropyl)-N-methylmethanamine

C7H13N — CID 121207399

IUPAC1-(1-ethenylcyclopropyl)-N-methylmethanamine
SMILESC=CC1(CNC)CC1
InChIInChI=1S/C7H13N/c1-3-7(4-5-7)6-8-2/h3,8H,1,4-6H2,2H3
InChIKeyDXRXXZPANCHJSL-UHFFFAOYSA-N
MW111.19 g/mol
LogP1.17
Rot. Bonds3

About 1-(1-ethenylcyclopropyl)-N-methylmethanamine

1-(1-ethenylcyclopropyl)-N-methylmethanamine (PubChem CID 121207399) has the molecular formula C7H13N and a molecular weight of 111.19 g/mol. Its IUPAC name is 1-(1-ethenylcyclopropyl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(1-ethenylcyclopropyl)-N-methylmethanamine
PubChem CID121207399
Molecular FormulaC7H13N
Molecular Weight111.19 g/mol
Exact Mass111.10
IUPAC Name1-(1-ethenylcyclopropyl)-N-methylmethanamine
SMILESC=CC1(CNC)CC1
InChIInChI=1S/C7H13N/c1-3-7(4-5-7)6-8-2/h3,8H,1,4-6H2,2H3
InChIKeyDXRXXZPANCHJSL-UHFFFAOYSA-N
XLogP1.17
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500111.19
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-(1-ethenylcyclopropyl)-N-methylmethanamine?
The IUPAC name of 1-(1-ethenylcyclopropyl)-N-methylmethanamine (CID 121207399) is 1-(1-ethenylcyclopropyl)-N-methylmethanamine.
What is the SMILES notation for 1-(1-ethenylcyclopropyl)-N-methylmethanamine?
The canonical SMILES for 1-(1-ethenylcyclopropyl)-N-methylmethanamine is C=CC1(CNC)CC1.
What is the InChIKey of 1-(1-ethenylcyclopropyl)-N-methylmethanamine?
The InChIKey is DXRXXZPANCHJSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13N/c1-3-7(4-5-7)6-8-2/h3,8H,1,4-6H2,2H3.
What are the key properties of 1-(1-ethenylcyclopropyl)-N-methylmethanamine?
1-(1-ethenylcyclopropyl)-N-methylmethanamine has a molecular weight of 111.19 g/mol, XLogP of 1.17, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-ethenylcyclopropyl)-N-methylmethanamine is sourced from PubChem (CID 121207399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).