N-[2-(dimethylamino)ethyl]-9-methoxy-5,6-dimethylpyrido[4,3-b]carbazole-1-carboxamide

C23H26N4O2 — CID 11741133

IUPACN-[2-(dimethylamino)ethyl]-9-methoxy-5,6-dimethylpyrido[4,3-b]carbazole-1-carboxamide
SMILESCOc1ccc2c(c1)c1cc3c(C(=O)NCCN(C)C)nccc3c(C)c1n2C
InChIInChI=1S/C23H26N4O2/c1-14-16-8-9-24-21(23(28)25-10-11-26(2)3)18(16)13-19-17-12-15(29-5)6-7-20(17)27(4)22(14)19/h6-9,12-13H,10-11H2,1-5H3,(H,25,28)
InChIKeyRSKLKXULBJOANY-UHFFFAOYSA-N
MW390.49 g/mol
LogP3.49
Rot. Bonds5

About N-[2-(dimethylamino)ethyl]-9-methoxy-5,6-dimethylpyrido[4,3-b]carbazole-1-carboxamide

N-[2-(dimethylamino)ethyl]-9-methoxy-5,6-dimethylpyrido[4,3-b]carbazole-1-carboxamide (PubChem CID 11741133) has the molecular formula C23H26N4O2 and a molecular weight of 390.49 g/mol. Its IUPAC name is N-[2-(dimethylamino)ethyl]-9-methoxy-5,6-dimethylpyrido[4,3-b]carbazole-1-carboxamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)ethyl]-9-methoxy-5,6-dimethylpyrido[4,3-b]carbazole-1-carboxamide
PubChem CID11741133
Molecular FormulaC23H26N4O2
Molecular Weight390.49 g/mol
Exact Mass390.21
IUPAC NameN-[2-(dimethylamino)ethyl]-9-methoxy-5,6-dimethylpyrido[4,3-b]carbazole-1-carboxamide
SMILESCOc1ccc2c(c1)c1cc3c(C(=O)NCCN(C)C)nccc3c(C)c1n2C
InChIInChI=1S/C23H26N4O2/c1-14-16-8-9-24-21(23(28)25-10-11-26(2)3)18(16)13-19-17-12-15(29-5)6-7-20(17)27(4)22(14)19/h6-9,12-13H,10-11H2,1-5H3,(H,25,28)
InChIKeyRSKLKXULBJOANY-UHFFFAOYSA-N
XLogP3.49
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.49
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)ethyl]-9-methoxy-5,6-dimethylpyrido[4,3-b]carbazole-1-carboxamide?
The IUPAC name of N-[2-(dimethylamino)ethyl]-9-methoxy-5,6-dimethylpyrido[4,3-b]carbazole-1-carboxamide (CID 11741133) is N-[2-(dimethylamino)ethyl]-9-methoxy-5,6-dimethylpyrido[4,3-b]carbazole-1-carboxamide.
What is the SMILES notation for N-[2-(dimethylamino)ethyl]-9-methoxy-5,6-dimethylpyrido[4,3-b]carbazole-1-carboxamide?
The canonical SMILES for N-[2-(dimethylamino)ethyl]-9-methoxy-5,6-dimethylpyrido[4,3-b]carbazole-1-carboxamide is COc1ccc2c(c1)c1cc3c(C(=O)NCCN(C)C)nccc3c(C)c1n2C.
What is the InChIKey of N-[2-(dimethylamino)ethyl]-9-methoxy-5,6-dimethylpyrido[4,3-b]carbazole-1-carboxamide?
The InChIKey is RSKLKXULBJOANY-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N4O2/c1-14-16-8-9-24-21(23(28)25-10-11-26(2)3)18(16)13-19-17-12-15(29-5)6-7-20(17)27(4)22(14)19/h6-9,12-13H,10-11H2,1-5H3,(H,25,28).
What are the key properties of N-[2-(dimethylamino)ethyl]-9-methoxy-5,6-dimethylpyrido[4,3-b]carbazole-1-carboxamide?
N-[2-(dimethylamino)ethyl]-9-methoxy-5,6-dimethylpyrido[4,3-b]carbazole-1-carboxamide has a molecular weight of 390.49 g/mol, XLogP of 3.49, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)ethyl]-9-methoxy-5,6-dimethylpyrido[4,3-b]carbazole-1-carboxamide is sourced from PubChem (CID 11741133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).