ethyl 3-[[2-(7-methyl-1H-indol-3-yl)acetyl]amino]pyridine-2-carboxylate

C19H19N3O3 — CID 75373207

IUPACethyl 3-[[2-(7-methyl-1H-indol-3-yl)acetyl]amino]pyridine-2-carboxylate
SMILESCCOC(=O)c1ncccc1NC(=O)Cc1c[nH]c2c(C)cccc12
InChIInChI=1S/C19H19N3O3/c1-3-25-19(24)18-15(8-5-9-20-18)22-16(23)10-13-11-21-17-12(2)6-4-7-14(13)17/h4-9,11,21H,3,10H2,1-2H3,(H,22,23)
InChIKeyCTQLOHYIYJFGTC-UHFFFAOYSA-N
MW337.38 g/mol
LogP3.23
Rot. Bonds5

About ethyl 3-[[2-(7-methyl-1H-indol-3-yl)acetyl]amino]pyridine-2-carboxylate

ethyl 3-[[2-(7-methyl-1H-indol-3-yl)acetyl]amino]pyridine-2-carboxylate (PubChem CID 75373207) has the molecular formula C19H19N3O3 and a molecular weight of 337.38 g/mol. Its IUPAC name is ethyl 3-[[2-(7-methyl-1H-indol-3-yl)acetyl]amino]pyridine-2-carboxylate.

Molecular Properties

Compound Nameethyl 3-[[2-(7-methyl-1H-indol-3-yl)acetyl]amino]pyridine-2-carboxylate
PubChem CID75373207
Molecular FormulaC19H19N3O3
Molecular Weight337.38 g/mol
Exact Mass337.14
IUPAC Nameethyl 3-[[2-(7-methyl-1H-indol-3-yl)acetyl]amino]pyridine-2-carboxylate
SMILESCCOC(=O)c1ncccc1NC(=O)Cc1c[nH]c2c(C)cccc12
InChIInChI=1S/C19H19N3O3/c1-3-25-19(24)18-15(8-5-9-20-18)22-16(23)10-13-11-21-17-12(2)6-4-7-14(13)17/h4-9,11,21H,3,10H2,1-2H3,(H,22,23)
InChIKeyCTQLOHYIYJFGTC-UHFFFAOYSA-N
XLogP3.23
TPSA84.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.38
LogP ≤ 53.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze ethyl 3-[[2-(7-methyl-1H-indol-3-yl)acetyl]amino]pyridine-2-carboxylate with MolForge

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Related Compounds

3-methyl-2-[[2-(7-methyl-1H-indol-3-yl)acetyl]amino]pentanoic acid
CID 119211734
N,N-diethyl-2-(7-methyl-1H-indol-3-yl)acetamide
CID 110855149
3-[[2-(2-methylphenyl)acetyl]amino]pyridine-2-carboxylic acid
CID 104740245
methyl 3-[[2-(2-bromophenyl)acetyl]amino]pyridine-2-carboxylate
CID 122147311
N-(2-chloro-3-pyridinyl)-2-(1H-indol-3-yl)acetamide
CID 10869874
3-(ethoxymethyl)-7-methyl-1H-indole
CID 117186252
2-[[2-(7-methyl-1H-indol-3-yl)acetyl]amino]propanoic acid
CID 119225264
ethyl 3-fluoropyridine-2-carboxylate
CID 46311381
N-[(2-hydroxycyclopentyl)methyl]-2-(7-methyl-1H-indol-3-yl)acetamide
CID 111471037
N-[(3-hydroxythiolan-3-yl)methyl]-2-(7-methyl-1H-indol-3-yl)acetamide
CID 111597192
3-hydroxy-4-[[2-(7-methyl-1H-indol-3-yl)acetyl]amino]butanoic acid
CID 138048367
2-(1H-indol-3-yl)-N-(3-methyl-4-pyridinyl)acetamide
CID 63671729

Frequently Asked Questions

What is the IUPAC name of ethyl 3-[[2-(7-methyl-1H-indol-3-yl)acetyl]amino]pyridine-2-carboxylate?
The IUPAC name of ethyl 3-[[2-(7-methyl-1H-indol-3-yl)acetyl]amino]pyridine-2-carboxylate (CID 75373207) is ethyl 3-[[2-(7-methyl-1H-indol-3-yl)acetyl]amino]pyridine-2-carboxylate.
What is the SMILES notation for ethyl 3-[[2-(7-methyl-1H-indol-3-yl)acetyl]amino]pyridine-2-carboxylate?
The canonical SMILES for ethyl 3-[[2-(7-methyl-1H-indol-3-yl)acetyl]amino]pyridine-2-carboxylate is CCOC(=O)c1ncccc1NC(=O)Cc1c[nH]c2c(C)cccc12.
What is the InChIKey of ethyl 3-[[2-(7-methyl-1H-indol-3-yl)acetyl]amino]pyridine-2-carboxylate?
The InChIKey is CTQLOHYIYJFGTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O3/c1-3-25-19(24)18-15(8-5-9-20-18)22-16(23)10-13-11-21-17-12(2)6-4-7-14(13)17/h4-9,11,21H,3,10H2,1-2H3,(H,22,23).
What are the key properties of ethyl 3-[[2-(7-methyl-1H-indol-3-yl)acetyl]amino]pyridine-2-carboxylate?
ethyl 3-[[2-(7-methyl-1H-indol-3-yl)acetyl]amino]pyridine-2-carboxylate has a molecular weight of 337.38 g/mol, XLogP of 3.23, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 3-[[2-(7-methyl-1H-indol-3-yl)acetyl]amino]pyridine-2-carboxylate is sourced from PubChem (CID 75373207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).