N-(2-hydroxyethyl)-2-indol-1-yl-N-[(2-methoxyphenyl)methyl]acetamide

C20H22N2O3 — CID 110907472

IUPACN-(2-hydroxyethyl)-2-indol-1-yl-N-[(2-methoxyphenyl)methyl]acetamide
SMILESCOc1ccccc1CN(CCO)C(=O)Cn1ccc2ccccc21
InChIInChI=1S/C20H22N2O3/c1-25-19-9-5-3-7-17(19)14-22(12-13-23)20(24)15-21-11-10-16-6-2-4-8-18(16)21/h2-11,23H,12-15H2,1H3
InChIKeyAUFJBUROHXUGOM-UHFFFAOYSA-N
MW338.41 g/mol
LogP2.67
Rot. Bonds7

About N-(2-hydroxyethyl)-2-indol-1-yl-N-[(2-methoxyphenyl)methyl]acetamide

N-(2-hydroxyethyl)-2-indol-1-yl-N-[(2-methoxyphenyl)methyl]acetamide (PubChem CID 110907472) has the molecular formula C20H22N2O3 and a molecular weight of 338.41 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-2-indol-1-yl-N-[(2-methoxyphenyl)methyl]acetamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-2-indol-1-yl-N-[(2-methoxyphenyl)methyl]acetamide
PubChem CID110907472
Molecular FormulaC20H22N2O3
Molecular Weight338.41 g/mol
Exact Mass338.16
IUPAC NameN-(2-hydroxyethyl)-2-indol-1-yl-N-[(2-methoxyphenyl)methyl]acetamide
SMILESCOc1ccccc1CN(CCO)C(=O)Cn1ccc2ccccc21
InChIInChI=1S/C20H22N2O3/c1-25-19-9-5-3-7-17(19)14-22(12-13-23)20(24)15-21-11-10-16-6-2-4-8-18(16)21/h2-11,23H,12-15H2,1H3
InChIKeyAUFJBUROHXUGOM-UHFFFAOYSA-N
XLogP2.67
TPSA54.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.41
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-chloro-N-(2-hydroxyethyl)-N-[(2-methoxyphenyl)methyl]propanamide
CID 54875800
2-[2-[2-hydroxyethyl-[(2-methoxyphenyl)methyl]amino]-2-oxoethyl]sulfanylacetic acid
CID 104569624
ethyl N-(2-hydroxyethyl)-N-[(2-methoxyphenyl)methyl]carbamate
CID 64593009
N-(2-hydroxyethyl)-N-[(2-methoxyphenyl)methyl]-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 115950154
2-amino-N-(2-hydroxyethyl)-N-[(2-methoxyphenyl)methyl]propanamide
CID 54874200
2-(tert-butylamino)-N-(2-hydroxyethyl)-N-[(2-methoxyphenyl)methyl]acetamide
CID 78960889
2-hydroxyethyl N-(2-hydroxyethyl)-N-[(2-methoxyphenyl)methyl]carbamate
CID 79345926
N-(2-hydroxyethyl)-N-[(2-methoxyphenyl)methyl]prop-2-enamide
CID 54875824
N-(2-hydroxyethyl)-N-[(2-methoxyphenyl)methyl]-3-(propan-2-ylamino)propanamide
CID 60952867
N-(2-hydroxyethyl)-N-[(2-methoxyphenyl)methyl]-2-(prop-2-enylamino)acetamide
CID 79279066
3-(dimethylamino)-N-(2-hydroxyethyl)-N-[(2-methoxyphenyl)methyl]benzamide
CID 47078427
2-(butan-2-ylamino)-N-(2-hydroxyethyl)-N-[(2-methoxyphenyl)methyl]acetamide
CID 60952866

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-2-indol-1-yl-N-[(2-methoxyphenyl)methyl]acetamide?
The IUPAC name of N-(2-hydroxyethyl)-2-indol-1-yl-N-[(2-methoxyphenyl)methyl]acetamide (CID 110907472) is N-(2-hydroxyethyl)-2-indol-1-yl-N-[(2-methoxyphenyl)methyl]acetamide.
What is the SMILES notation for N-(2-hydroxyethyl)-2-indol-1-yl-N-[(2-methoxyphenyl)methyl]acetamide?
The canonical SMILES for N-(2-hydroxyethyl)-2-indol-1-yl-N-[(2-methoxyphenyl)methyl]acetamide is COc1ccccc1CN(CCO)C(=O)Cn1ccc2ccccc21.
What is the InChIKey of N-(2-hydroxyethyl)-2-indol-1-yl-N-[(2-methoxyphenyl)methyl]acetamide?
The InChIKey is AUFJBUROHXUGOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N2O3/c1-25-19-9-5-3-7-17(19)14-22(12-13-23)20(24)15-21-11-10-16-6-2-4-8-18(16)21/h2-11,23H,12-15H2,1H3.
What are the key properties of N-(2-hydroxyethyl)-2-indol-1-yl-N-[(2-methoxyphenyl)methyl]acetamide?
N-(2-hydroxyethyl)-2-indol-1-yl-N-[(2-methoxyphenyl)methyl]acetamide has a molecular weight of 338.41 g/mol, XLogP of 2.67, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-2-indol-1-yl-N-[(2-methoxyphenyl)methyl]acetamide is sourced from PubChem (CID 110907472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).