[(Z)-[6-ethyl-9-(pyridine-2-carbonyl)furo[3,2-c]carbazol-3-ylidene]amino] acetate

C24H19N3O4 — CID 89104974

IUPAC[(Z)-[6-ethyl-9-(pyridine-2-carbonyl)furo[3,2-c]carbazol-3-ylidene]amino] acetate
SMILESCCn1c2ccc(C(=O)c3ccccn3)cc2c2c3c(ccc21)/C(=N/OC(C)=O)CO3
InChIInChI=1S/C24H19N3O4/c1-3-27-20-9-7-15(23(29)18-6-4-5-11-25-18)12-17(20)22-21(27)10-8-16-19(13-30-24(16)22)26-31-14(2)28/h4-12H,3,13H2,1-2H3/b26-19+
InChIKeyCSEPEZSBQFNPTN-LGUFXXKBSA-N
MW413.43 g/mol
LogP4.10
Rot. Bonds4

About [(Z)-[6-ethyl-9-(pyridine-2-carbonyl)furo[3,2-c]carbazol-3-ylidene]amino] acetate

[(Z)-[6-ethyl-9-(pyridine-2-carbonyl)furo[3,2-c]carbazol-3-ylidene]amino] acetate (PubChem CID 89104974) has the molecular formula C24H19N3O4 and a molecular weight of 413.43 g/mol. Its IUPAC name is [(Z)-[6-ethyl-9-(pyridine-2-carbonyl)furo[3,2-c]carbazol-3-ylidene]amino] acetate.

Molecular Properties

Compound Name[(Z)-[6-ethyl-9-(pyridine-2-carbonyl)furo[3,2-c]carbazol-3-ylidene]amino] acetate
PubChem CID89104974
Molecular FormulaC24H19N3O4
Molecular Weight413.43 g/mol
Exact Mass413.14
IUPAC Name[(Z)-[6-ethyl-9-(pyridine-2-carbonyl)furo[3,2-c]carbazol-3-ylidene]amino] acetate
SMILESCCn1c2ccc(C(=O)c3ccccn3)cc2c2c3c(ccc21)/C(=N/OC(C)=O)CO3
InChIInChI=1S/C24H19N3O4/c1-3-27-20-9-7-15(23(29)18-6-4-5-11-25-18)12-17(20)22-21(27)10-8-16-19(13-30-24(16)22)26-31-14(2)28/h4-12H,3,13H2,1-2H3/b26-19+
InChIKeyCSEPEZSBQFNPTN-LGUFXXKBSA-N
XLogP4.10
TPSA82.78 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500413.43
LogP ≤ 54.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'oxime_2', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

[(Z)-[9-(4-bromo-2-methylbenzoyl)-6-ethylfuro[3,2-c]carbazol-3-ylidene]amino] acetate
CID 89104919
[(Z)-[6-ethyl-9-(2-methylbenzoyl)furo[3,2-c]carbazol-3-ylidene]amino] 2-hydroxy-2-methylpropanoate
CID 88591619
[(Z)-[6-ethyl-9-(2-methylbenzoyl)furo[3,2-c]carbazol-3-ylidene]amino] oxolane-2-carboxylate
CID 89105009
[(E)-[16-(4-bromobenzoyl)-12-ethyl-7-oxo-3-oxa-12-azatetracyclo[9.7.0.02,8.013,18]octadeca-1(11),2(8),9,13(18),14,16-hexaen-6-ylidene]amino] acetate
CID 58490096
[(E)-[7-ethyl-10-(2-methylbenzoyl)-2,3-dihydropyrano[3,2-c]carbazol-4-ylidene]amino] 2-methylpropanoate
CID 89104999
[(Z)-[6-ethyl-3-oxo-9-(2-propan-2-ylbenzoyl)furo[3,2-c]carbazol-2-ylidene]amino] acetate
CID 58490060
[4-[(2Z)-2-acetyloxyimino-6-ethyl-3-oxofuro[3,2-c]carbazole-9-carbonyl]phenyl] acetate
CID 58490017
[(Z)-(9-acetyl-6-ethyl-3-iminofuro[3,2-c]carbazol-2-ylidene)amino] acetate
CID 172916588
[(E)-[12-ethyl-16-(2-methylbenzoyl)-7-oxo-3-oxa-12-azatetracyclo[9.7.0.02,8.013,18]octadeca-1(11),2(8),9,13(18),14,16-hexaen-6-ylidene]amino] 2-methyl-2-[methyl(pentyl)amino]propanoate
CID 88858045
[(E)-[12-ethyl-16-(2-methylbenzoyl)-7-oxo-3-oxa-12-azatetracyclo[9.7.0.02,8.013,18]octadeca-1(11),2(8),9,13(18),14,16-hexaen-6-ylidene]amino] 4-methylbenzenesulfonate
CID 58489996
[(Z)-(6-benzoyl-9-ethyl-3-oxofuro[2,3-b]carbazol-2-ylidene)amino] acetate
CID 58490074
[[12-ethyl-16-(2-methylbenzoyl)-7-oxo-3-oxa-12-azatetracyclo[9.7.0.02,8.013,18]octadeca-1(11),2(8),5,9,13(18),14,16-heptaen-6-yl]amino] benzoate
CID 123790344

Frequently Asked Questions

What is the IUPAC name of [(Z)-[6-ethyl-9-(pyridine-2-carbonyl)furo[3,2-c]carbazol-3-ylidene]amino] acetate?
The IUPAC name of [(Z)-[6-ethyl-9-(pyridine-2-carbonyl)furo[3,2-c]carbazol-3-ylidene]amino] acetate (CID 89104974) is [(Z)-[6-ethyl-9-(pyridine-2-carbonyl)furo[3,2-c]carbazol-3-ylidene]amino] acetate.
What is the SMILES notation for [(Z)-[6-ethyl-9-(pyridine-2-carbonyl)furo[3,2-c]carbazol-3-ylidene]amino] acetate?
The canonical SMILES for [(Z)-[6-ethyl-9-(pyridine-2-carbonyl)furo[3,2-c]carbazol-3-ylidene]amino] acetate is CCn1c2ccc(C(=O)c3ccccn3)cc2c2c3c(ccc21)/C(=N/OC(C)=O)CO3.
What is the InChIKey of [(Z)-[6-ethyl-9-(pyridine-2-carbonyl)furo[3,2-c]carbazol-3-ylidene]amino] acetate?
The InChIKey is CSEPEZSBQFNPTN-LGUFXXKBSA-N. The full InChI is InChI=1S/C24H19N3O4/c1-3-27-20-9-7-15(23(29)18-6-4-5-11-25-18)12-17(20)22-21(27)10-8-16-19(13-30-24(16)22)26-31-14(2)28/h4-12H,3,13H2,1-2H3/b26-19+.
What are the key properties of [(Z)-[6-ethyl-9-(pyridine-2-carbonyl)furo[3,2-c]carbazol-3-ylidene]amino] acetate?
[(Z)-[6-ethyl-9-(pyridine-2-carbonyl)furo[3,2-c]carbazol-3-ylidene]amino] acetate has a molecular weight of 413.43 g/mol, XLogP of 4.10, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [(Z)-[6-ethyl-9-(pyridine-2-carbonyl)furo[3,2-c]carbazol-3-ylidene]amino] acetate is sourced from PubChem (CID 89104974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).