6-(dimethylamino)-N-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenylmethyl)pyridazine-3-carboxamide

C24H24N4O — CID 56511348

IUPAC6-(dimethylamino)-N-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenylmethyl)pyridazine-3-carboxamide
SMILESCN(C)c1ccc(C(=O)NCC2CC3c4ccccc4C2c2ccccc23)nn1
InChIInChI=1S/C24H24N4O/c1-28(2)22-12-11-21(26-27-22)24(29)25-14-15-13-20-16-7-3-5-9-18(16)23(15)19-10-6-4-8-17(19)20/h3-12,15,20,23H,13-14H2,1-2H3,(H,25,29)
InChIKeyOIJMUYMKRNXOHK-UHFFFAOYSA-N
MW384.48 g/mol
LogP3.57
Rot. Bonds4

About 6-(dimethylamino)-N-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenylmethyl)pyridazine-3-carboxamide

6-(dimethylamino)-N-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenylmethyl)pyridazine-3-carboxamide (PubChem CID 56511348) has the molecular formula C24H24N4O and a molecular weight of 384.48 g/mol. Its IUPAC name is 6-(dimethylamino)-N-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenylmethyl)pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-(dimethylamino)-N-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenylmethyl)pyridazine-3-carboxamide
PubChem CID56511348
Molecular FormulaC24H24N4O
Molecular Weight384.48 g/mol
Exact Mass384.20
IUPAC Name6-(dimethylamino)-N-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenylmethyl)pyridazine-3-carboxamide
SMILESCN(C)c1ccc(C(=O)NCC2CC3c4ccccc4C2c2ccccc23)nn1
InChIInChI=1S/C24H24N4O/c1-28(2)22-12-11-21(26-27-22)24(29)25-14-15-13-20-16-7-3-5-9-18(16)23(15)19-10-6-4-8-17(19)20/h3-12,15,20,23H,13-14H2,1-2H3,(H,25,29)
InChIKeyOIJMUYMKRNXOHK-UHFFFAOYSA-N
XLogP3.57
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.48
LogP ≤ 53.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(dimethylamino)-N-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenylmethyl)pyridazine-3-carboxamide?
The IUPAC name of 6-(dimethylamino)-N-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenylmethyl)pyridazine-3-carboxamide (CID 56511348) is 6-(dimethylamino)-N-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenylmethyl)pyridazine-3-carboxamide.
What is the SMILES notation for 6-(dimethylamino)-N-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenylmethyl)pyridazine-3-carboxamide?
The canonical SMILES for 6-(dimethylamino)-N-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenylmethyl)pyridazine-3-carboxamide is CN(C)c1ccc(C(=O)NCC2CC3c4ccccc4C2c2ccccc23)nn1.
What is the InChIKey of 6-(dimethylamino)-N-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenylmethyl)pyridazine-3-carboxamide?
The InChIKey is OIJMUYMKRNXOHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N4O/c1-28(2)22-12-11-21(26-27-22)24(29)25-14-15-13-20-16-7-3-5-9-18(16)23(15)19-10-6-4-8-17(19)20/h3-12,15,20,23H,13-14H2,1-2H3,(H,25,29).
What are the key properties of 6-(dimethylamino)-N-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenylmethyl)pyridazine-3-carboxamide?
6-(dimethylamino)-N-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenylmethyl)pyridazine-3-carboxamide has a molecular weight of 384.48 g/mol, XLogP of 3.57, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(dimethylamino)-N-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenylmethyl)pyridazine-3-carboxamide is sourced from PubChem (CID 56511348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).