N,N'-bis(6-bicyclo[3.2.0]hept-3-enylideneamino)pentanediamide

C19H24N4O2 — CID 4155511

IUPACN,N'-bis(6-bicyclo[3.2.0]hept-3-enylideneamino)pentanediamide
SMILESO=C(CCCC(=O)NN=C1CC2CC=CC12)NN=C1CC2CC=CC12
InChIInChI=1S/C19H24N4O2/c24-18(22-20-16-10-12-4-1-6-14(12)16)8-3-9-19(25)23-21-17-11-13-5-2-7-15(13)17/h1-2,6-7,12-15H,3-5,8-11H2,(H,22,24)(H,23,25)
InChIKeySPYVKROHLSFMFH-UHFFFAOYSA-N
MW340.43 g/mol
LogP2.29
Rot. Bonds6

About N,N'-bis(6-bicyclo[3.2.0]hept-3-enylideneamino)pentanediamide

N,N'-bis(6-bicyclo[3.2.0]hept-3-enylideneamino)pentanediamide (PubChem CID 4155511) has the molecular formula C19H24N4O2 and a molecular weight of 340.43 g/mol. Its IUPAC name is N,N'-bis(6-bicyclo[3.2.0]hept-3-enylideneamino)pentanediamide.

Molecular Properties

Compound NameN,N'-bis(6-bicyclo[3.2.0]hept-3-enylideneamino)pentanediamide
PubChem CID4155511
Molecular FormulaC19H24N4O2
Molecular Weight340.43 g/mol
Exact Mass340.19
IUPAC NameN,N'-bis(6-bicyclo[3.2.0]hept-3-enylideneamino)pentanediamide
SMILESO=C(CCCC(=O)NN=C1CC2CC=CC12)NN=C1CC2CC=CC12
InChIInChI=1S/C19H24N4O2/c24-18(22-20-16-10-12-4-1-6-14(12)16)8-3-9-19(25)23-21-17-11-13-5-2-7-15(13)17/h1-2,6-7,12-15H,3-5,8-11H2,(H,22,24)(H,23,25)
InChIKeySPYVKROHLSFMFH-UHFFFAOYSA-N
XLogP2.29
TPSA82.92 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.43
LogP ≤ 52.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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'~1~,N'~7~-Dibicyclo[3.2.0]hept-3-EN-6-ylidenheptanedihydrazide
CID 9624837
N'~1~,N'~6~-Dibicyclo[3.2.0]hept-3-EN-6-ylidenhexanedihydrazide
CID 9670029
N,N'-bis(6-bicyclo[3.2.0]hept-3-enylideneamino)butanediamide
CID 3298786
N-(6-bicyclo[3.2.0]hept-2-enylideneamino)decanamide
CID 3349650
N,N'-bis(6-bicyclo[3.2.0]hept-3-enylideneamino)oxamide
CID 3455787
N,N'-bis(6-bicyclo[3.2.0]hept-3-enylideneamino)heptanediamide
CID 3536131
N-(6-bicyclo[3.2.0]hept-2-enylideneamino)nonanamide
CID 4193660
N,N'-bis(6-bicyclo[3.2.0]hept-3-enylideneamino)hexanediamide
CID 4421725
N,N'-bis(6-bicyclo[3.2.0]hept-3-enylideneamino)octanediamide
CID 4517496
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-[(Z)-6-bicyclo[3.2.0]hept-2-enylideneamino]decanamide
CID 5800437

Frequently Asked Questions

What is the IUPAC name of N,N'-bis(6-bicyclo[3.2.0]hept-3-enylideneamino)pentanediamide?
The IUPAC name of N,N'-bis(6-bicyclo[3.2.0]hept-3-enylideneamino)pentanediamide (CID 4155511) is N,N'-bis(6-bicyclo[3.2.0]hept-3-enylideneamino)pentanediamide.
What is the SMILES notation for N,N'-bis(6-bicyclo[3.2.0]hept-3-enylideneamino)pentanediamide?
The canonical SMILES for N,N'-bis(6-bicyclo[3.2.0]hept-3-enylideneamino)pentanediamide is O=C(CCCC(=O)NN=C1CC2CC=CC12)NN=C1CC2CC=CC12.
What is the InChIKey of N,N'-bis(6-bicyclo[3.2.0]hept-3-enylideneamino)pentanediamide?
The InChIKey is SPYVKROHLSFMFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O2/c24-18(22-20-16-10-12-4-1-6-14(12)16)8-3-9-19(25)23-21-17-11-13-5-2-7-15(13)17/h1-2,6-7,12-15H,3-5,8-11H2,(H,22,24)(H,23,25).
What are the key properties of N,N'-bis(6-bicyclo[3.2.0]hept-3-enylideneamino)pentanediamide?
N,N'-bis(6-bicyclo[3.2.0]hept-3-enylideneamino)pentanediamide has a molecular weight of 340.43 g/mol, XLogP of 2.29, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N'-bis(6-bicyclo[3.2.0]hept-3-enylideneamino)pentanediamide is sourced from PubChem (CID 4155511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).