ethyl 8-methoxy-9H-pyrido[2,3-b]indole-6-carboxylate

C15H14N2O3 — CID 135059817

IUPACethyl 8-methoxy-9H-pyrido[2,3-b]indole-6-carboxylate
SMILESCCOC(=O)c1cc(OC)c2[nH]c3ncccc3c2c1
InChIInChI=1S/C15H14N2O3/c1-3-20-15(18)9-7-11-10-5-4-6-16-14(10)17-13(11)12(8-9)19-2/h4-8H,3H2,1-2H3,(H,16,17)
InChIKeyAMWOYYNCBZMFOM-UHFFFAOYSA-N
MW270.29 g/mol
LogP2.90
Rot. Bonds3

About ethyl 8-methoxy-9H-pyrido[2,3-b]indole-6-carboxylate

ethyl 8-methoxy-9H-pyrido[2,3-b]indole-6-carboxylate (PubChem CID 135059817) has the molecular formula C15H14N2O3 and a molecular weight of 270.29 g/mol. Its IUPAC name is ethyl 8-methoxy-9H-pyrido[2,3-b]indole-6-carboxylate.

Molecular Properties

Compound Nameethyl 8-methoxy-9H-pyrido[2,3-b]indole-6-carboxylate
PubChem CID135059817
Molecular FormulaC15H14N2O3
Molecular Weight270.29 g/mol
Exact Mass270.10
IUPAC Nameethyl 8-methoxy-9H-pyrido[2,3-b]indole-6-carboxylate
SMILESCCOC(=O)c1cc(OC)c2[nH]c3ncccc3c2c1
InChIInChI=1S/C15H14N2O3/c1-3-20-15(18)9-7-11-10-5-4-6-16-14(10)17-13(11)12(8-9)19-2/h4-8H,3H2,1-2H3,(H,16,17)
InChIKeyAMWOYYNCBZMFOM-UHFFFAOYSA-N
XLogP2.90
TPSA64.21 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.29
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze ethyl 8-methoxy-9H-pyrido[2,3-b]indole-6-carboxylate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

ethyl 9H-pyrido[2,3-b]indole-8-carboxylate
CID 135002978
ethyl 2-oxo-1H-1,8-naphthyridine-4-carboxylate
CID 76849396
ethyl 8-methoxy-1,5-naphthyridine-3-carboxylate
CID 59256763
ethyl 8-methoxy-4-(3-methoxypropoxy)naphthalene-2-carboxylate
CID 22128544
ethyl 2-hydroxy-3-[(2-methoxyphenyl)iminomethyl]-1H-pyrrolo[2,3-b]pyridine-5-carboxylate
CID 135800764
1-O-ethyl 4-O-methyl 2,6-dimethoxybenzene-1,4-dicarboxylate
CID 11402920
ethyl 4-methoxy-3-(pyridin-3-ylmethoxy)benzoate
CID 91682546
ethyl 2-hydroxy-2-(9H-pyrido[2,3-b]indol-6-yl)acetate
CID 117428854
ethyl 3-amino-4-bromo-5-methoxybenzoate
CID 171021080
ethyl 2-oxo-1H-1,8-naphthyridine-3-carboxylate
CID 11564777
5-ethoxycarbonyl-3-methoxypyridine-2-carboxylic acid
CID 22923766
ethyl 4-methoxy-1-benzothiophene-6-carboxylate
CID 11459009

Frequently Asked Questions

What is the IUPAC name of ethyl 8-methoxy-9H-pyrido[2,3-b]indole-6-carboxylate?
The IUPAC name of ethyl 8-methoxy-9H-pyrido[2,3-b]indole-6-carboxylate (CID 135059817) is ethyl 8-methoxy-9H-pyrido[2,3-b]indole-6-carboxylate.
What is the SMILES notation for ethyl 8-methoxy-9H-pyrido[2,3-b]indole-6-carboxylate?
The canonical SMILES for ethyl 8-methoxy-9H-pyrido[2,3-b]indole-6-carboxylate is CCOC(=O)c1cc(OC)c2[nH]c3ncccc3c2c1.
What is the InChIKey of ethyl 8-methoxy-9H-pyrido[2,3-b]indole-6-carboxylate?
The InChIKey is AMWOYYNCBZMFOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O3/c1-3-20-15(18)9-7-11-10-5-4-6-16-14(10)17-13(11)12(8-9)19-2/h4-8H,3H2,1-2H3,(H,16,17).
What are the key properties of ethyl 8-methoxy-9H-pyrido[2,3-b]indole-6-carboxylate?
ethyl 8-methoxy-9H-pyrido[2,3-b]indole-6-carboxylate has a molecular weight of 270.29 g/mol, XLogP of 2.90, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 8-methoxy-9H-pyrido[2,3-b]indole-6-carboxylate is sourced from PubChem (CID 135059817), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).