(9,9-dimethyl-1,2,3,4,10,11-hexahydroisochromeno[4,3-g]chromen-5-ylidene)hydrazine

C18H22N2O2 — CID 71965539

IUPAC(9,9-dimethyl-1,2,3,4,10,11-hexahydroisochromeno[4,3-g]chromen-5-ylidene)hydrazine
SMILESCC1(C)CCc2cc3c4c(c(=NN)oc3cc2O1)CCCC4
InChIInChI=1S/C18H22N2O2/c1-18(2)8-7-11-9-14-12-5-3-4-6-13(12)17(20-19)21-16(14)10-15(11)22-18/h9-10H,3-8,19H2,1-2H3
InChIKeyWZXAZWCTODXSBZ-UHFFFAOYSA-N
MW298.39 g/mol
LogP3.19
Rot. Bonds

About (9,9-dimethyl-1,2,3,4,10,11-hexahydroisochromeno[4,3-g]chromen-5-ylidene)hydrazine

(9,9-dimethyl-1,2,3,4,10,11-hexahydroisochromeno[4,3-g]chromen-5-ylidene)hydrazine (PubChem CID 71965539) has the molecular formula C18H22N2O2 and a molecular weight of 298.39 g/mol. Its IUPAC name is (9,9-dimethyl-1,2,3,4,10,11-hexahydroisochromeno[4,3-g]chromen-5-ylidene)hydrazine.

Molecular Properties

Compound Name(9,9-dimethyl-1,2,3,4,10,11-hexahydroisochromeno[4,3-g]chromen-5-ylidene)hydrazine
PubChem CID71965539
Molecular FormulaC18H22N2O2
Molecular Weight298.39 g/mol
Exact Mass298.17
IUPAC Name(9,9-dimethyl-1,2,3,4,10,11-hexahydroisochromeno[4,3-g]chromen-5-ylidene)hydrazine
SMILESCC1(C)CCc2cc3c4c(c(=NN)oc3cc2O1)CCCC4
InChIInChI=1S/C18H22N2O2/c1-18(2)8-7-11-9-14-12-5-3-4-6-13(12)17(20-19)21-16(14)10-15(11)22-18/h9-10H,3-8,19H2,1-2H3
InChIKeyWZXAZWCTODXSBZ-UHFFFAOYSA-N
XLogP3.19
TPSA60.75 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.39
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

4-amino-N-[(Z)-(9,9-dimethyl-1,2,3,4,10,11-hexahydroisochromeno[4,3-g]chromen-5-ylidene)amino]butanamide
CID 92859139
[(Z)-spiro[1,2,3,4,10,11-hexahydroisochromeno[4,3-g]chromene-9,1'-cyclohexane]-5-ylideneamino] N-(4-fluorophenyl)carbamate
CID 95369235
(5R)-3'-methylspiro[4,17-dioxatetracyclo[8.7.0.03,8.011,15]heptadeca-1(10),2,8,11(15)-tetraene-5,1'-cyclohexane]-16-one
CID 43912854
5-hydroxy-17,17-dimethyl-3,12,16-trioxapentacyclo[11.8.0.02,10.04,9.015,20]henicosa-1(13),2(10),4(9),5,7,14,20-heptaen-11-one
CID 5318636
[(Z)-spiro[4,17-dioxatetracyclo[8.7.0.03,8.011,15]heptadeca-1(10),2,8,11(15)-tetraene-5,1'-cyclohexane]-16-ylideneamino] N-[3-(trifluoromethyl)phenyl]carbamate
CID 95369238
2,2-dimethyl-3,4-dihydrochromene-7-sulfonamide
CID 142779358
1-(2,2-dimethyl-3,4-dihydrochromen-7-yl)cyclobutan-1-amine
CID 117334916
6-chloro-2,2-dimethyl-3,4-dihydrochromene
CID 11769444
6-benzyl-2,2-dimethyl-3,4-dihydrochromene
CID 16729493
2,2,7-trimethyl-3,4-dihydrochromene-6-carboxylic acid
CID 117097203
7-chloro-6-fluoro-2,2-dimethyl-3,4-dihydrochromene
CID 171787942
(1R)-1-(2,2-dimethyl-3,4-dihydrochromen-6-yl)ethanamine
CID 42129765

Frequently Asked Questions

What is the IUPAC name of (9,9-dimethyl-1,2,3,4,10,11-hexahydroisochromeno[4,3-g]chromen-5-ylidene)hydrazine?
The IUPAC name of (9,9-dimethyl-1,2,3,4,10,11-hexahydroisochromeno[4,3-g]chromen-5-ylidene)hydrazine (CID 71965539) is (9,9-dimethyl-1,2,3,4,10,11-hexahydroisochromeno[4,3-g]chromen-5-ylidene)hydrazine.
What is the SMILES notation for (9,9-dimethyl-1,2,3,4,10,11-hexahydroisochromeno[4,3-g]chromen-5-ylidene)hydrazine?
The canonical SMILES for (9,9-dimethyl-1,2,3,4,10,11-hexahydroisochromeno[4,3-g]chromen-5-ylidene)hydrazine is CC1(C)CCc2cc3c4c(c(=NN)oc3cc2O1)CCCC4.
What is the InChIKey of (9,9-dimethyl-1,2,3,4,10,11-hexahydroisochromeno[4,3-g]chromen-5-ylidene)hydrazine?
The InChIKey is WZXAZWCTODXSBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O2/c1-18(2)8-7-11-9-14-12-5-3-4-6-13(12)17(20-19)21-16(14)10-15(11)22-18/h9-10H,3-8,19H2,1-2H3.
What are the key properties of (9,9-dimethyl-1,2,3,4,10,11-hexahydroisochromeno[4,3-g]chromen-5-ylidene)hydrazine?
(9,9-dimethyl-1,2,3,4,10,11-hexahydroisochromeno[4,3-g]chromen-5-ylidene)hydrazine has a molecular weight of 298.39 g/mol, XLogP of 3.19, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (9,9-dimethyl-1,2,3,4,10,11-hexahydroisochromeno[4,3-g]chromen-5-ylidene)hydrazine is sourced from PubChem (CID 71965539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).