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

C11H14N2O — CID 4588938

IUPACN-(6-bicyclo[3.2.0]hept-2-enylideneamino)cyclopropanecarboxamide
SMILESO=C(NN=C1CC2C=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)
InChIKeyVTYITOYQDBKNHY-UHFFFAOYSA-N
MW190.25 g/mol
LogP1.46
Rot. Bonds2

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

N-(6-bicyclo[3.2.0]hept-2-enylideneamino)cyclopropanecarboxamide (PubChem CID 4588938) has the molecular formula C11H14N2O and a molecular weight of 190.25 g/mol. Its IUPAC name is N-(6-bicyclo[3.2.0]hept-2-enylideneamino)cyclopropanecarboxamide.

Molecular Properties

Compound NameN-(6-bicyclo[3.2.0]hept-2-enylideneamino)cyclopropanecarboxamide
PubChem CID4588938
Molecular FormulaC11H14N2O
Molecular Weight190.25 g/mol
Exact Mass190.11
IUPAC NameN-(6-bicyclo[3.2.0]hept-2-enylideneamino)cyclopropanecarboxamide
SMILESO=C(NN=C1CC2C=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)
InChIKeyVTYITOYQDBKNHY-UHFFFAOYSA-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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Related Compounds

N-(6-bicyclo[3.2.0]hept-2-enylideneamino)decanamide
CID 3349650
N-(6-bicyclo[3.2.0]hept-2-enylideneamino)octanamide
CID 3361607
N-(6-bicyclo[3.2.0]hept-2-enylideneamino)cyclohexanecarboxamide
CID 3456277
N-(6-bicyclo[3.2.0]hept-2-enylideneamino)-3-methylbutanamide
CID 3626824
N-(6-bicyclo[3.2.0]hept-2-enylideneamino)heptanamide
CID 3724265
N-(6-bicyclo[3.2.0]hept-2-enylideneamino)dodecanamide
CID 4182915
N'-(6-bicyclo[3.2.0]hept-2-enylideneamino)oxamide
CID 4183850
N-(6-bicyclo[3.2.0]hept-2-enylideneamino)nonanamide
CID 4193660
N-(6-bicyclo[3.2.0]hept-2-enylideneamino)hexanamide
CID 4517502
N-(6-bicyclo[3.2.0]hept-2-enylideneamino)undecanamide
CID 4564775
N-(6-bicyclo[3.2.0]hept-2-enylideneamino)acetamide
CID 5155039
N-[(Z)-6-bicyclo[3.2.0]hept-2-enylideneamino]decanamide
CID 5800437

Frequently Asked Questions

What is the IUPAC name of N-(6-bicyclo[3.2.0]hept-2-enylideneamino)cyclopropanecarboxamide?
The IUPAC name of N-(6-bicyclo[3.2.0]hept-2-enylideneamino)cyclopropanecarboxamide (CID 4588938) is N-(6-bicyclo[3.2.0]hept-2-enylideneamino)cyclopropanecarboxamide.
What is the SMILES notation for N-(6-bicyclo[3.2.0]hept-2-enylideneamino)cyclopropanecarboxamide?
The canonical SMILES for N-(6-bicyclo[3.2.0]hept-2-enylideneamino)cyclopropanecarboxamide is O=C(NN=C1CC2C=CCC12)C1CC1.
What is the InChIKey of N-(6-bicyclo[3.2.0]hept-2-enylideneamino)cyclopropanecarboxamide?
The InChIKey is VTYITOYQDBKNHY-UHFFFAOYSA-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).
What are the key properties of N-(6-bicyclo[3.2.0]hept-2-enylideneamino)cyclopropanecarboxamide?
N-(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-(6-bicyclo[3.2.0]hept-2-enylideneamino)cyclopropanecarboxamide is sourced from PubChem (CID 4588938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).