N-[(E)-2,3-dihydrobenzo[f]chromen-1-ylideneamino]benzamide

C20H16N2O2 — CID 56838549

IUPACN-[(E)-2,3-dihydrobenzo[f]chromen-1-ylideneamino]benzamide
SMILESO=C(N/N=C1\CCOc2ccc3ccccc3c21)c1ccccc1
InChIInChI=1S/C20H16N2O2/c23-20(15-7-2-1-3-8-15)22-21-17-12-13-24-18-11-10-14-6-4-5-9-16(14)19(17)18/h1-11H,12-13H2,(H,22,23)/b21-17+
InChIKeyYADVSLXAFPXQBV-HEHNFIMWSA-N
MW316.36 g/mol
LogP3.76
Rot. Bonds2

About N-[(E)-2,3-dihydrobenzo[f]chromen-1-ylideneamino]benzamide

N-[(E)-2,3-dihydrobenzo[f]chromen-1-ylideneamino]benzamide (PubChem CID 56838549) has the molecular formula C20H16N2O2 and a molecular weight of 316.36 g/mol. Its IUPAC name is N-[(E)-2,3-dihydrobenzo[f]chromen-1-ylideneamino]benzamide.

Molecular Properties

Compound NameN-[(E)-2,3-dihydrobenzo[f]chromen-1-ylideneamino]benzamide
PubChem CID56838549
Molecular FormulaC20H16N2O2
Molecular Weight316.36 g/mol
Exact Mass316.12
IUPAC NameN-[(E)-2,3-dihydrobenzo[f]chromen-1-ylideneamino]benzamide
SMILESO=C(N/N=C1\CCOc2ccc3ccccc3c21)c1ccccc1
InChIInChI=1S/C20H16N2O2/c23-20(15-7-2-1-3-8-15)22-21-17-12-13-24-18-11-10-14-6-4-5-9-16(14)19(17)18/h1-11H,12-13H2,(H,22,23)/b21-17+
InChIKeyYADVSLXAFPXQBV-HEHNFIMWSA-N
XLogP3.76
TPSA50.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.36
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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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Related Compounds

(2,3-dihydrobenzo[f]chromen-1-ylideneamino)thiourea
CID 2806980
N-[(Z)-naphthalen-1-ylmethylideneamino]benzamide
CID 5397614
N-(naphthalen-1-ylmethylideneamino)-2,3-dihydro-1,4-benzodioxine-6-carboxamide
CID 5056514
1,2-dihydrobenzo[e][1]benzofuran;hydrate
CID 118007569
12,15,18,21,42,45,48,51-octaoxanonacyclo[50.8.0.02,11.03,8.022,31.025,30.032,41.033,38.055,60]hexaconta-1(52),2(11),3,5,7,9,22(31),23,25,27,29,32(41),33,35,37,39,53,55,57,59-icosaene
CID 101060260
(2,3-dihydrobenzo[f]chromen-1-ylidenemethylidene-λ3-iodanyl) acetate
CID 163978219
N-[(Z)-2,3-dihydrochromen-4-ylideneamino]-2-pyridin-4-ylquinoline-4-carboxamide
CID 9216689
N-(cyclododecylideneamino)benzamide
CID 4147051
[(4E)-4-methoxyimino-2,3-dihydrochromen-5-yl]-naphthalen-1-ylmethanone
CID 72712552
N-[(E)-2,3-dihydro-1,4-benzodioxin-6-ylmethylideneamino]benzamide
CID 6909474
N-[(E)-(7-hydroxynaphthalen-1-yl)methylideneamino]benzamide
CID 137290368
N-[(E)-[(5Z)-5-(2,3-dihydro-1-benzofuran-5-ylmethylidene)-4-oxo-1,3-thiazolidin-2-ylidene]amino]benzamide
CID 135873603

Frequently Asked Questions

What is the IUPAC name of N-[(E)-2,3-dihydrobenzo[f]chromen-1-ylideneamino]benzamide?
The IUPAC name of N-[(E)-2,3-dihydrobenzo[f]chromen-1-ylideneamino]benzamide (CID 56838549) is N-[(E)-2,3-dihydrobenzo[f]chromen-1-ylideneamino]benzamide.
What is the SMILES notation for N-[(E)-2,3-dihydrobenzo[f]chromen-1-ylideneamino]benzamide?
The canonical SMILES for N-[(E)-2,3-dihydrobenzo[f]chromen-1-ylideneamino]benzamide is O=C(N/N=C1\CCOc2ccc3ccccc3c21)c1ccccc1.
What is the InChIKey of N-[(E)-2,3-dihydrobenzo[f]chromen-1-ylideneamino]benzamide?
The InChIKey is YADVSLXAFPXQBV-HEHNFIMWSA-N. The full InChI is InChI=1S/C20H16N2O2/c23-20(15-7-2-1-3-8-15)22-21-17-12-13-24-18-11-10-14-6-4-5-9-16(14)19(17)18/h1-11H,12-13H2,(H,22,23)/b21-17+.
What are the key properties of N-[(E)-2,3-dihydrobenzo[f]chromen-1-ylideneamino]benzamide?
N-[(E)-2,3-dihydrobenzo[f]chromen-1-ylideneamino]benzamide has a molecular weight of 316.36 g/mol, XLogP of 3.76, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(E)-2,3-dihydrobenzo[f]chromen-1-ylideneamino]benzamide is sourced from PubChem (CID 56838549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).