N-[(Z)-6-bicyclo[3.2.0]hept-2-enylideneamino]cyclopropanecarboxamide

C11H14N2O — CID 6157921

IUPACN-[(Z)-6-bicyclo[3.2.0]hept-2-enylideneamino]cyclopropanecarboxamide
SMILESO=C(N/N=C1/CC2C=CCC12)C1CC1
InChIInChI=1S/C11H14N2O/c14-11(7-4-5-7)13-12-10-6-8-2-1-3-9(8)10/h1-2,7-9H,3-6H2,(H,13,14)/b12-10-
InChIKeyVTYITOYQDBKNHY-BENRWUELSA-N
MW190.25 g/mol
LogP1.46
Rot. Bonds2

About N-[(Z)-6-bicyclo[3.2.0]hept-2-enylideneamino]cyclopropanecarboxamide

N-[(Z)-6-bicyclo[3.2.0]hept-2-enylideneamino]cyclopropanecarboxamide (PubChem CID 6157921) has the molecular formula C11H14N2O and a molecular weight of 190.25 g/mol. Its IUPAC name is N-[(Z)-6-bicyclo[3.2.0]hept-2-enylideneamino]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[(Z)-6-bicyclo[3.2.0]hept-2-enylideneamino]cyclopropanecarboxamide
PubChem CID6157921
Molecular FormulaC11H14N2O
Molecular Weight190.25 g/mol
Exact Mass190.11
IUPAC NameN-[(Z)-6-bicyclo[3.2.0]hept-2-enylideneamino]cyclopropanecarboxamide
SMILESO=C(N/N=C1/CC2C=CCC12)C1CC1
InChIInChI=1S/C11H14N2O/c14-11(7-4-5-7)13-12-10-6-8-2-1-3-9(8)10/h1-2,7-9H,3-6H2,(H,13,14)/b12-10-
InChIKeyVTYITOYQDBKNHY-BENRWUELSA-N
XLogP1.46
TPSA41.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.25
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', '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 N-[(Z)-6-bicyclo[3.2.0]hept-2-enylideneamino]cyclopropanecarboxamide?
The IUPAC name of N-[(Z)-6-bicyclo[3.2.0]hept-2-enylideneamino]cyclopropanecarboxamide (CID 6157921) is N-[(Z)-6-bicyclo[3.2.0]hept-2-enylideneamino]cyclopropanecarboxamide.
What is the SMILES notation for N-[(Z)-6-bicyclo[3.2.0]hept-2-enylideneamino]cyclopropanecarboxamide?
The canonical SMILES for N-[(Z)-6-bicyclo[3.2.0]hept-2-enylideneamino]cyclopropanecarboxamide is O=C(N/N=C1/CC2C=CCC12)C1CC1.
What is the InChIKey of N-[(Z)-6-bicyclo[3.2.0]hept-2-enylideneamino]cyclopropanecarboxamide?
The InChIKey is VTYITOYQDBKNHY-BENRWUELSA-N. The full InChI is InChI=1S/C11H14N2O/c14-11(7-4-5-7)13-12-10-6-8-2-1-3-9(8)10/h1-2,7-9H,3-6H2,(H,13,14)/b12-10-.
What are the key properties of N-[(Z)-6-bicyclo[3.2.0]hept-2-enylideneamino]cyclopropanecarboxamide?
N-[(Z)-6-bicyclo[3.2.0]hept-2-enylideneamino]cyclopropanecarboxamide has a molecular weight of 190.25 g/mol, XLogP of 1.46, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-6-bicyclo[3.2.0]hept-2-enylideneamino]cyclopropanecarboxamide is sourced from PubChem (CID 6157921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).