N-(3-acetamidophenyl)-5-methoxy-1-methylindole-2-carboxamide

C19H19N3O3 — CID 110861255

IUPACN-(3-acetamidophenyl)-5-methoxy-1-methylindole-2-carboxamide
SMILESCOc1ccc2c(c1)cc(C(=O)Nc1cccc(NC(C)=O)c1)n2C
InChIInChI=1S/C19H19N3O3/c1-12(23)20-14-5-4-6-15(11-14)21-19(24)18-10-13-9-16(25-3)7-8-17(13)22(18)2/h4-11H,1-3H3,(H,20,23)(H,21,24)
InChIKeyREUJBHGFKBRKQI-UHFFFAOYSA-N
MW337.38 g/mol
LogP3.40
Rot. Bonds4

About N-(3-acetamidophenyl)-5-methoxy-1-methylindole-2-carboxamide

N-(3-acetamidophenyl)-5-methoxy-1-methylindole-2-carboxamide (PubChem CID 110861255) has the molecular formula C19H19N3O3 and a molecular weight of 337.38 g/mol. Its IUPAC name is N-(3-acetamidophenyl)-5-methoxy-1-methylindole-2-carboxamide.

Molecular Properties

Compound NameN-(3-acetamidophenyl)-5-methoxy-1-methylindole-2-carboxamide
PubChem CID110861255
Molecular FormulaC19H19N3O3
Molecular Weight337.38 g/mol
Exact Mass337.14
IUPAC NameN-(3-acetamidophenyl)-5-methoxy-1-methylindole-2-carboxamide
SMILESCOc1ccc2c(c1)cc(C(=O)Nc1cccc(NC(C)=O)c1)n2C
InChIInChI=1S/C19H19N3O3/c1-12(23)20-14-5-4-6-15(11-14)21-19(24)18-10-13-9-16(25-3)7-8-17(13)22(18)2/h4-11H,1-3H3,(H,20,23)(H,21,24)
InChIKeyREUJBHGFKBRKQI-UHFFFAOYSA-N
XLogP3.40
TPSA72.36 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.38
LogP ≤ 53.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-methoxy-1-methyl-N-phenylindole-2-carboxamide
CID 10707870
N-[2-[(3-methoxyphenyl)carbamoyl]phenyl]-1-methylindole-2-carboxamide
CID 60529287
3,5-diacetamido-N-(3-methoxyphenyl)benzamide
CID 18104274
N-(1-aminopropan-2-yl)-5-methoxy-1-methylindole-2-carboxamide
CID 110833437
methane;N-(3-methoxyphenyl)acetamide
CID 161026095
N-(3-acetamidophenyl)-2-amino-4-methoxybenzamide
CID 82546305
(2S)-2-[(5-methoxy-1-methylindole-2-carbonyl)amino]-3-methylbutanoate
CID 7070170
N-[[3-(dimethylamino)phenyl]methyl]-5-methoxy-1-methylindole-2-carboxamide
CID 70739975
N-[3-[(3-methoxyphenyl)carbamoylamino]phenyl]acetamide
CID 6467465
N-[(S)-cyclopropyl-(6-methyl-2-pyridinyl)methyl]-5-methoxy-1-methylindole-2-carboxamide
CID 99946822
N-[(1R,2R)-2-acetamido-2,3-dihydro-1H-inden-1-yl]-5-methoxy-1-methylindole-2-carboxamide
CID 70717237
N-(3-acetamidophenyl)-6-(4-methoxyanilino)-2-methylpyrimidine-4-carboxamide
CID 112850553

Frequently Asked Questions

What is the IUPAC name of N-(3-acetamidophenyl)-5-methoxy-1-methylindole-2-carboxamide?
The IUPAC name of N-(3-acetamidophenyl)-5-methoxy-1-methylindole-2-carboxamide (CID 110861255) is N-(3-acetamidophenyl)-5-methoxy-1-methylindole-2-carboxamide.
What is the SMILES notation for N-(3-acetamidophenyl)-5-methoxy-1-methylindole-2-carboxamide?
The canonical SMILES for N-(3-acetamidophenyl)-5-methoxy-1-methylindole-2-carboxamide is COc1ccc2c(c1)cc(C(=O)Nc1cccc(NC(C)=O)c1)n2C.
What is the InChIKey of N-(3-acetamidophenyl)-5-methoxy-1-methylindole-2-carboxamide?
The InChIKey is REUJBHGFKBRKQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O3/c1-12(23)20-14-5-4-6-15(11-14)21-19(24)18-10-13-9-16(25-3)7-8-17(13)22(18)2/h4-11H,1-3H3,(H,20,23)(H,21,24).
What are the key properties of N-(3-acetamidophenyl)-5-methoxy-1-methylindole-2-carboxamide?
N-(3-acetamidophenyl)-5-methoxy-1-methylindole-2-carboxamide has a molecular weight of 337.38 g/mol, XLogP of 3.40, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetamidophenyl)-5-methoxy-1-methylindole-2-carboxamide is sourced from PubChem (CID 110861255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).