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

C18H18N2O2 — CID 9208634

IUPACN-(2-methoxy-5-methylphenyl)-1-methylindole-3-carboxamide
SMILESCOc1ccc(C)cc1NC(=O)c1cn(C)c2ccccc12
InChIInChI=1S/C18H18N2O2/c1-12-8-9-17(22-3)15(10-12)19-18(21)14-11-20(2)16-7-5-4-6-13(14)16/h4-11H,1-3H3,(H,19,21)
InChIKeyLOKUJNXCWCLNEX-UHFFFAOYSA-N
MW294.35 g/mol
LogP3.75
Rot. Bonds3

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

N-(2-methoxy-5-methylphenyl)-1-methylindole-3-carboxamide (PubChem CID 9208634) has the molecular formula C18H18N2O2 and a molecular weight of 294.35 g/mol. Its IUPAC name is N-(2-methoxy-5-methylphenyl)-1-methylindole-3-carboxamide.

Molecular Properties

Compound NameN-(2-methoxy-5-methylphenyl)-1-methylindole-3-carboxamide
PubChem CID9208634
Molecular FormulaC18H18N2O2
Molecular Weight294.35 g/mol
Exact Mass294.14
IUPAC NameN-(2-methoxy-5-methylphenyl)-1-methylindole-3-carboxamide
SMILESCOc1ccc(C)cc1NC(=O)c1cn(C)c2ccccc12
InChIInChI=1S/C18H18N2O2/c1-12-8-9-17(22-3)15(10-12)19-18(21)14-11-20(2)16-7-5-4-6-13(14)16/h4-11H,1-3H3,(H,19,21)
InChIKeyLOKUJNXCWCLNEX-UHFFFAOYSA-N
XLogP3.75
TPSA43.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.35
LogP ≤ 53.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,5-dimethoxyphenyl)-1-methylindole-3-carboxamide
CID 25343212
N-(5-chloro-2-methoxyphenyl)-1-methylindole-3-carboxamide
CID 29202307
CID 87065455
CID 87065455
N-(2-methoxy-5-methylphenyl)-1,3-dimethylindole-2-carboxamide
CID 113204445
3-bromo-N-(2-methoxy-5-methylphenyl)-1-methylindole-2-carboxamide
CID 55663937
N-[3-(difluoromethoxy)-4-methoxyphenyl]-1-methylindole-3-carboxamide
CID 46530558
1-[1-(2-methoxyethyl)indol-3-yl]-3-(2-methoxy-5-methylphenyl)urea
CID 16803764
N-(5-chloro-2-methylphenyl)-1-methylindole-3-carboxamide
CID 40716876
4-N,5-N-bis(2-methoxy-5-methylphenyl)-1-methylpyrazole-4,5-dicarboxamide
CID 29096938
1-methyl-N-phenylindole-3-carboxamide
CID 9038340
N-(5-chloro-2-methoxyphenyl)-1-methylindole-4-carboxamide
CID 112520804
4-bromo-N-(2-methoxy-5-methylphenyl)-1-methylpyrrole-2-carboxamide
CID 17410270

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxy-5-methylphenyl)-1-methylindole-3-carboxamide?
The IUPAC name of N-(2-methoxy-5-methylphenyl)-1-methylindole-3-carboxamide (CID 9208634) is N-(2-methoxy-5-methylphenyl)-1-methylindole-3-carboxamide.
What is the SMILES notation for N-(2-methoxy-5-methylphenyl)-1-methylindole-3-carboxamide?
The canonical SMILES for N-(2-methoxy-5-methylphenyl)-1-methylindole-3-carboxamide is COc1ccc(C)cc1NC(=O)c1cn(C)c2ccccc12.
What is the InChIKey of N-(2-methoxy-5-methylphenyl)-1-methylindole-3-carboxamide?
The InChIKey is LOKUJNXCWCLNEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O2/c1-12-8-9-17(22-3)15(10-12)19-18(21)14-11-20(2)16-7-5-4-6-13(14)16/h4-11H,1-3H3,(H,19,21).
What are the key properties of N-(2-methoxy-5-methylphenyl)-1-methylindole-3-carboxamide?
N-(2-methoxy-5-methylphenyl)-1-methylindole-3-carboxamide has a molecular weight of 294.35 g/mol, XLogP of 3.75, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxy-5-methylphenyl)-1-methylindole-3-carboxamide is sourced from PubChem (CID 9208634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).