N-[6-(2-methoxyethoxy)-3-pyridinyl]-2,3-dimethyl-1H-indole-5-carboxamide

C19H21N3O3 — CID 51114178

IUPACN-[6-(2-methoxyethoxy)-3-pyridinyl]-2,3-dimethyl-1H-indole-5-carboxamide
SMILESCOCCOc1ccc(NC(=O)c2ccc3[nH]c(C)c(C)c3c2)cn1
InChIInChI=1S/C19H21N3O3/c1-12-13(2)21-17-6-4-14(10-16(12)17)19(23)22-15-5-7-18(20-11-15)25-9-8-24-3/h4-7,10-11,21H,8-9H2,1-3H3,(H,22,23)
InChIKeyHFXXAHQBWWMWIV-UHFFFAOYSA-N
MW339.40 g/mol
LogP3.46
Rot. Bonds6

About N-[6-(2-methoxyethoxy)-3-pyridinyl]-2,3-dimethyl-1H-indole-5-carboxamide

N-[6-(2-methoxyethoxy)-3-pyridinyl]-2,3-dimethyl-1H-indole-5-carboxamide (PubChem CID 51114178) has the molecular formula C19H21N3O3 and a molecular weight of 339.40 g/mol. Its IUPAC name is N-[6-(2-methoxyethoxy)-3-pyridinyl]-2,3-dimethyl-1H-indole-5-carboxamide.

Molecular Properties

Compound NameN-[6-(2-methoxyethoxy)-3-pyridinyl]-2,3-dimethyl-1H-indole-5-carboxamide
PubChem CID51114178
Molecular FormulaC19H21N3O3
Molecular Weight339.40 g/mol
Exact Mass339.16
IUPAC NameN-[6-(2-methoxyethoxy)-3-pyridinyl]-2,3-dimethyl-1H-indole-5-carboxamide
SMILESCOCCOc1ccc(NC(=O)c2ccc3[nH]c(C)c(C)c3c2)cn1
InChIInChI=1S/C19H21N3O3/c1-12-13(2)21-17-6-4-14(10-16(12)17)19(23)22-15-5-7-18(20-11-15)25-9-8-24-3/h4-7,10-11,21H,8-9H2,1-3H3,(H,22,23)
InChIKeyHFXXAHQBWWMWIV-UHFFFAOYSA-N
XLogP3.46
TPSA76.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.40
LogP ≤ 53.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'indol_3yl_alk(461)', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[4-[3-(dimethylamino)propoxy]phenyl]-2,3-dimethyl-1H-indole-5-carboxamide
CID 86898701
propan-2-yl 4-[(2,3-dimethyl-1H-indole-5-carbonyl)amino]benzoate
CID 18288127
3-cyano-N-[6-(2-methoxyethoxy)-3-pyridinyl]benzamide
CID 43069880
methyl N-[4-[[(2,3-dimethyl-1H-indole-5-carbonyl)amino]methyl]phenyl]carbamate
CID 60517718
2,3-dimethyl-N-(4-methyl-1H-pyrazol-5-yl)-1H-indole-5-carboxamide
CID 115630320
methyl 2,3-dimethyl-1H-indole-5-carboxylate
CID 11344717
N-(3-fluorophenyl)-2,3-dimethyl-1H-indole-5-carboxamide
CID 26579048
3-[(2,3-dimethyl-1H-indole-5-carbonyl)amino]benzoic acid
CID 23474692
N-(1-methoxy-2-methylpropan-2-yl)-2,3-dimethyl-1H-indole-5-carboxamide
CID 115606615
N-[6-(2-methoxyethoxy)-3-pyridinyl]-2-(methylamino)acetamide
CID 43704151
N-[3-(butanoylamino)phenyl]-2,3-dimethyl-1H-indole-5-carboxamide
CID 87040999
N-[4-[(4-methoxyphenyl)sulfamoyl]phenyl]-2,3-dimethyl-1H-indole-5-carboxamide
CID 23474703

Frequently Asked Questions

What is the IUPAC name of N-[6-(2-methoxyethoxy)-3-pyridinyl]-2,3-dimethyl-1H-indole-5-carboxamide?
The IUPAC name of N-[6-(2-methoxyethoxy)-3-pyridinyl]-2,3-dimethyl-1H-indole-5-carboxamide (CID 51114178) is N-[6-(2-methoxyethoxy)-3-pyridinyl]-2,3-dimethyl-1H-indole-5-carboxamide.
What is the SMILES notation for N-[6-(2-methoxyethoxy)-3-pyridinyl]-2,3-dimethyl-1H-indole-5-carboxamide?
The canonical SMILES for N-[6-(2-methoxyethoxy)-3-pyridinyl]-2,3-dimethyl-1H-indole-5-carboxamide is COCCOc1ccc(NC(=O)c2ccc3[nH]c(C)c(C)c3c2)cn1.
What is the InChIKey of N-[6-(2-methoxyethoxy)-3-pyridinyl]-2,3-dimethyl-1H-indole-5-carboxamide?
The InChIKey is HFXXAHQBWWMWIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O3/c1-12-13(2)21-17-6-4-14(10-16(12)17)19(23)22-15-5-7-18(20-11-15)25-9-8-24-3/h4-7,10-11,21H,8-9H2,1-3H3,(H,22,23).
What are the key properties of N-[6-(2-methoxyethoxy)-3-pyridinyl]-2,3-dimethyl-1H-indole-5-carboxamide?
N-[6-(2-methoxyethoxy)-3-pyridinyl]-2,3-dimethyl-1H-indole-5-carboxamide has a molecular weight of 339.40 g/mol, XLogP of 3.46, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(2-methoxyethoxy)-3-pyridinyl]-2,3-dimethyl-1H-indole-5-carboxamide is sourced from PubChem (CID 51114178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).