N-[2-(3-methoxyphenyl)ethyl]-1-methylindole-2-carboxamide

C19H20N2O2 — CID 113207074

IUPACN-[2-(3-methoxyphenyl)ethyl]-1-methylindole-2-carboxamide
SMILESCOc1cccc(CCNC(=O)c2cc3ccccc3n2C)c1
InChIInChI=1S/C19H20N2O2/c1-21-17-9-4-3-7-15(17)13-18(21)19(22)20-11-10-14-6-5-8-16(12-14)23-2/h3-9,12-13H,10-11H2,1-2H3,(H,20,22)
InChIKeyZKTBSAVIZSXUPN-UHFFFAOYSA-N
MW308.38 g/mol
LogP3.16
Rot. Bonds5

About N-[2-(3-methoxyphenyl)ethyl]-1-methylindole-2-carboxamide

N-[2-(3-methoxyphenyl)ethyl]-1-methylindole-2-carboxamide (PubChem CID 113207074) has the molecular formula C19H20N2O2 and a molecular weight of 308.38 g/mol. Its IUPAC name is N-[2-(3-methoxyphenyl)ethyl]-1-methylindole-2-carboxamide.

Molecular Properties

Compound NameN-[2-(3-methoxyphenyl)ethyl]-1-methylindole-2-carboxamide
PubChem CID113207074
Molecular FormulaC19H20N2O2
Molecular Weight308.38 g/mol
Exact Mass308.15
IUPAC NameN-[2-(3-methoxyphenyl)ethyl]-1-methylindole-2-carboxamide
SMILESCOc1cccc(CCNC(=O)c2cc3ccccc3n2C)c1
InChIInChI=1S/C19H20N2O2/c1-21-17-9-4-3-7-15(17)13-18(21)19(22)20-11-10-14-6-5-8-16(12-14)23-2/h3-9,12-13H,10-11H2,1-2H3,(H,20,22)
InChIKeyZKTBSAVIZSXUPN-UHFFFAOYSA-N
XLogP3.16
TPSA43.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.38
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-[(4-methoxybenzoyl)amino]ethyl]-1-methylindole-2-carboxamide
CID 29130862
N-[2-[[1-(3-methoxyphenyl)-5-oxopyrrolidine-3-carbonyl]amino]ethyl]-1-methylindole-2-carboxamide
CID 42653320
3,5-dibromo-N-[2-(3-methoxyphenyl)ethyl]benzamide
CID 107980616
ethyl 1-[2-(3-methoxyphenyl)ethyl]indole-2-carboxylate
CID 68856722
N-[2-(3-methoxyphenyl)ethyl]-2-oxopropanamide
CID 110478240
4-amino-1-ethyl-N-[2-(3-methoxyphenyl)ethyl]pyrrole-2-carboxamide
CID 107843317
N-[2-(3-methoxyphenyl)ethyl]-1-methyl-2-oxo-1,8-naphthyridine-3-carboxamide
CID 7619614
N-[2-(3-methoxyphenyl)ethyl]furan-3-carboxamide
CID 47041893
phenyl N-[2-(3-methoxyphenyl)ethyl]carbamate
CID 110755565
N-[2-(3-methoxyphenyl)ethyl]-2-(1,2,5-trimethylpyrrol-3-yl)acetamide
CID 110773658
N-[2-(4-chlorophenyl)ethyl]-1-methyl-5-phenoxyindole-2-carboxamide
CID 3321068
1-N-[2-(3-methoxyphenyl)ethyl]-3-N-propan-2-ylimidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109066366

Frequently Asked Questions

What is the IUPAC name of N-[2-(3-methoxyphenyl)ethyl]-1-methylindole-2-carboxamide?
The IUPAC name of N-[2-(3-methoxyphenyl)ethyl]-1-methylindole-2-carboxamide (CID 113207074) is N-[2-(3-methoxyphenyl)ethyl]-1-methylindole-2-carboxamide.
What is the SMILES notation for N-[2-(3-methoxyphenyl)ethyl]-1-methylindole-2-carboxamide?
The canonical SMILES for N-[2-(3-methoxyphenyl)ethyl]-1-methylindole-2-carboxamide is COc1cccc(CCNC(=O)c2cc3ccccc3n2C)c1.
What is the InChIKey of N-[2-(3-methoxyphenyl)ethyl]-1-methylindole-2-carboxamide?
The InChIKey is ZKTBSAVIZSXUPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O2/c1-21-17-9-4-3-7-15(17)13-18(21)19(22)20-11-10-14-6-5-8-16(12-14)23-2/h3-9,12-13H,10-11H2,1-2H3,(H,20,22).
What are the key properties of N-[2-(3-methoxyphenyl)ethyl]-1-methylindole-2-carboxamide?
N-[2-(3-methoxyphenyl)ethyl]-1-methylindole-2-carboxamide has a molecular weight of 308.38 g/mol, XLogP of 3.16, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3-methoxyphenyl)ethyl]-1-methylindole-2-carboxamide is sourced from PubChem (CID 113207074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).