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

C23H26N4O2 — CID 10023296

IUPACN-[2-(dimethylamino)ethyl]-6-ethyl-9-hydroxy-5-methylpyrido[4,3-b]carbazole-1-carboxamide
SMILESCCn1c2ccc(O)cc2c2cc3c(C(=O)NCCN(C)C)nccc3c(C)c21
InChIInChI=1S/C23H26N4O2/c1-5-27-20-7-6-15(28)12-17(20)19-13-18-16(14(2)22(19)27)8-9-24-21(18)23(29)25-10-11-26(3)4/h6-9,12-13,28H,5,10-11H2,1-4H3,(H,25,29)
InChIKeyOJTNGINNYSVXLW-UHFFFAOYSA-N
MW390.49 g/mol
LogP3.67
Rot. Bonds5

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

N-[2-(dimethylamino)ethyl]-6-ethyl-9-hydroxy-5-methylpyrido[4,3-b]carbazole-1-carboxamide (PubChem CID 10023296) has the molecular formula C23H26N4O2 and a molecular weight of 390.49 g/mol. Its IUPAC name is N-[2-(dimethylamino)ethyl]-6-ethyl-9-hydroxy-5-methylpyrido[4,3-b]carbazole-1-carboxamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)ethyl]-6-ethyl-9-hydroxy-5-methylpyrido[4,3-b]carbazole-1-carboxamide
PubChem CID10023296
Molecular FormulaC23H26N4O2
Molecular Weight390.49 g/mol
Exact Mass390.21
IUPAC NameN-[2-(dimethylamino)ethyl]-6-ethyl-9-hydroxy-5-methylpyrido[4,3-b]carbazole-1-carboxamide
SMILESCCn1c2ccc(O)cc2c2cc3c(C(=O)NCCN(C)C)nccc3c(C)c21
InChIInChI=1S/C23H26N4O2/c1-5-27-20-7-6-15(28)12-17(20)19-13-18-16(14(2)22(19)27)8-9-24-21(18)23(29)25-10-11-26(3)4/h6-9,12-13,28H,5,10-11H2,1-4H3,(H,25,29)
InChIKeyOJTNGINNYSVXLW-UHFFFAOYSA-N
XLogP3.67
TPSA70.39 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.49
LogP ≤ 53.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)ethyl]-6-ethyl-9-hydroxy-5-methylpyrido[4,3-b]carbazole-1-carboxamide?
The IUPAC name of N-[2-(dimethylamino)ethyl]-6-ethyl-9-hydroxy-5-methylpyrido[4,3-b]carbazole-1-carboxamide (CID 10023296) is N-[2-(dimethylamino)ethyl]-6-ethyl-9-hydroxy-5-methylpyrido[4,3-b]carbazole-1-carboxamide.
What is the SMILES notation for N-[2-(dimethylamino)ethyl]-6-ethyl-9-hydroxy-5-methylpyrido[4,3-b]carbazole-1-carboxamide?
The canonical SMILES for N-[2-(dimethylamino)ethyl]-6-ethyl-9-hydroxy-5-methylpyrido[4,3-b]carbazole-1-carboxamide is CCn1c2ccc(O)cc2c2cc3c(C(=O)NCCN(C)C)nccc3c(C)c21.
What is the InChIKey of N-[2-(dimethylamino)ethyl]-6-ethyl-9-hydroxy-5-methylpyrido[4,3-b]carbazole-1-carboxamide?
The InChIKey is OJTNGINNYSVXLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N4O2/c1-5-27-20-7-6-15(28)12-17(20)19-13-18-16(14(2)22(19)27)8-9-24-21(18)23(29)25-10-11-26(3)4/h6-9,12-13,28H,5,10-11H2,1-4H3,(H,25,29).
What are the key properties of N-[2-(dimethylamino)ethyl]-6-ethyl-9-hydroxy-5-methylpyrido[4,3-b]carbazole-1-carboxamide?
N-[2-(dimethylamino)ethyl]-6-ethyl-9-hydroxy-5-methylpyrido[4,3-b]carbazole-1-carboxamide has a molecular weight of 390.49 g/mol, XLogP of 3.67, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)ethyl]-6-ethyl-9-hydroxy-5-methylpyrido[4,3-b]carbazole-1-carboxamide is sourced from PubChem (CID 10023296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).