N-methyl-N-(2-phenylmethoxyethyl)-1H-indole-6-carboxamide

C19H20N2O2 — CID 166216963

IUPACN-methyl-N-(2-phenylmethoxyethyl)-1H-indole-6-carboxamide
SMILESCN(CCOCc1ccccc1)C(=O)c1ccc2cc[nH]c2c1
InChIInChI=1S/C19H20N2O2/c1-21(11-12-23-14-15-5-3-2-4-6-15)19(22)17-8-7-16-9-10-20-18(16)13-17/h2-10,13,20H,11-12,14H2,1H3
InChIKeyBTHZAHBLNSQSDN-UHFFFAOYSA-N
MW308.38 g/mol
LogP3.46
Rot. Bonds6

About N-methyl-N-(2-phenylmethoxyethyl)-1H-indole-6-carboxamide

N-methyl-N-(2-phenylmethoxyethyl)-1H-indole-6-carboxamide (PubChem CID 166216963) has the molecular formula C19H20N2O2 and a molecular weight of 308.38 g/mol. Its IUPAC name is N-methyl-N-(2-phenylmethoxyethyl)-1H-indole-6-carboxamide.

Molecular Properties

Compound NameN-methyl-N-(2-phenylmethoxyethyl)-1H-indole-6-carboxamide
PubChem CID166216963
Molecular FormulaC19H20N2O2
Molecular Weight308.38 g/mol
Exact Mass308.15
IUPAC NameN-methyl-N-(2-phenylmethoxyethyl)-1H-indole-6-carboxamide
SMILESCN(CCOCc1ccccc1)C(=O)c1ccc2cc[nH]c2c1
InChIInChI=1S/C19H20N2O2/c1-21(11-12-23-14-15-5-3-2-4-6-15)19(22)17-8-7-16-9-10-20-18(16)13-17/h2-10,13,20H,11-12,14H2,1H3
InChIKeyBTHZAHBLNSQSDN-UHFFFAOYSA-N
XLogP3.46
TPSA45.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.38
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

4-[1H-indole-6-carbonyl(methyl)amino]butanoic acid
CID 63749646
N-methyl-N-(3-methylsulfanylpropyl)-1H-indole-6-carboxamide
CID 114217639
N-(2,2-difluoroethyl)-N-methyl-1H-indole-6-carboxamide
CID 113231691
N-chloro-N-methyl-1H-indole-6-carboxamide
CID 156761567
N-butyl-N-methyl-1H-indole-5-carboxamide
CID 63717689
N-[(3-tert-butyl-1H-pyrazol-5-yl)methyl]-N-methyl-1H-indole-6-carboxamide
CID 91790635
2-methoxy-N-methyl-N-(2-phenylmethoxyethyl)acetamide
CID 130767377
2-amino-N-methyl-2-phenyl-N-(2-phenylmethoxyethyl)acetamide
CID 119345164
ethane;1H-indole-6-carboxylic acid
CID 142472960
N-methyl-N-[(5-methyl-1H-1,2,4-triazol-3-yl)methyl]-1H-indole-6-carboxamide
CID 64510794
N-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]-1H-indole-6-carboxamide
CID 63373207
N-(2-ethoxyethyl)-N-methylbenzamide
CID 81074695

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(2-phenylmethoxyethyl)-1H-indole-6-carboxamide?
The IUPAC name of N-methyl-N-(2-phenylmethoxyethyl)-1H-indole-6-carboxamide (CID 166216963) is N-methyl-N-(2-phenylmethoxyethyl)-1H-indole-6-carboxamide.
What is the SMILES notation for N-methyl-N-(2-phenylmethoxyethyl)-1H-indole-6-carboxamide?
The canonical SMILES for N-methyl-N-(2-phenylmethoxyethyl)-1H-indole-6-carboxamide is CN(CCOCc1ccccc1)C(=O)c1ccc2cc[nH]c2c1.
What is the InChIKey of N-methyl-N-(2-phenylmethoxyethyl)-1H-indole-6-carboxamide?
The InChIKey is BTHZAHBLNSQSDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O2/c1-21(11-12-23-14-15-5-3-2-4-6-15)19(22)17-8-7-16-9-10-20-18(16)13-17/h2-10,13,20H,11-12,14H2,1H3.
What are the key properties of N-methyl-N-(2-phenylmethoxyethyl)-1H-indole-6-carboxamide?
N-methyl-N-(2-phenylmethoxyethyl)-1H-indole-6-carboxamide has a molecular weight of 308.38 g/mol, XLogP of 3.46, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(2-phenylmethoxyethyl)-1H-indole-6-carboxamide is sourced from PubChem (CID 166216963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).