N-[2-(dimethylamino)ethyl]-2-(1-ethylindol-3-yl)-N-(pyridin-3-ylmethyl)acetamide

C22H28N4O — CID 46966320

IUPACN-[2-(dimethylamino)ethyl]-2-(1-ethylindol-3-yl)-N-(pyridin-3-ylmethyl)acetamide
SMILESCCn1cc(CC(=O)N(CCN(C)C)Cc2cccnc2)c2ccccc21
InChIInChI=1S/C22H28N4O/c1-4-25-17-19(20-9-5-6-10-21(20)25)14-22(27)26(13-12-24(2)3)16-18-8-7-11-23-15-18/h5-11,15,17H,4,12-14,16H2,1-3H3
InChIKeyYWQIWGZVTSSZGI-UHFFFAOYSA-N
MW364.49 g/mol
LogP3.19
Rot. Bonds8

About N-[2-(dimethylamino)ethyl]-2-(1-ethylindol-3-yl)-N-(pyridin-3-ylmethyl)acetamide

N-[2-(dimethylamino)ethyl]-2-(1-ethylindol-3-yl)-N-(pyridin-3-ylmethyl)acetamide (PubChem CID 46966320) has the molecular formula C22H28N4O and a molecular weight of 364.49 g/mol. Its IUPAC name is N-[2-(dimethylamino)ethyl]-2-(1-ethylindol-3-yl)-N-(pyridin-3-ylmethyl)acetamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)ethyl]-2-(1-ethylindol-3-yl)-N-(pyridin-3-ylmethyl)acetamide
PubChem CID46966320
Molecular FormulaC22H28N4O
Molecular Weight364.49 g/mol
Exact Mass364.23
IUPAC NameN-[2-(dimethylamino)ethyl]-2-(1-ethylindol-3-yl)-N-(pyridin-3-ylmethyl)acetamide
SMILESCCn1cc(CC(=O)N(CCN(C)C)Cc2cccnc2)c2ccccc21
InChIInChI=1S/C22H28N4O/c1-4-25-17-19(20-9-5-6-10-21(20)25)14-22(27)26(13-12-24(2)3)16-18-8-7-11-23-15-18/h5-11,15,17H,4,12-14,16H2,1-3H3
InChIKeyYWQIWGZVTSSZGI-UHFFFAOYSA-N
XLogP3.19
TPSA41.37 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.49
LogP ≤ 53.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(dimethylamino)ethyl]-N-(pyridin-3-ylmethyl)propanamide
CID 61243414
3-(aminomethyl)-N-[2-(dimethylamino)ethyl]-N-(pyridin-3-ylmethyl)pentanamide
CID 81083766
N-[2-(dimethylamino)ethyl]-2-[3,5-dimethyl-1-(2-methylphenyl)pyrazol-4-yl]-N-(pyridin-3-ylmethyl)acetamide
CID 16673897
N-[2-(dimethylamino)ethyl]-2-(2-methyl-4-phenyl-1,3-thiazol-5-yl)-N-(pyridin-3-ylmethyl)acetamide
CID 46966362
2-(2-methoxyphenyl)-N-propyl-N-(pyridin-3-ylmethyl)acetamide
CID 46997861
2-bromo-N-[2-(dimethylamino)ethyl]-N-(pyridin-3-ylmethyl)propanamide
CID 107904634
2-[[2-(1-ethylindol-3-yl)acetyl]-methylamino]-2-methylpropanoic acid
CID 119200487
tert-butyl N-[2-(dimethylamino)ethyl]-N-(pyridin-3-ylmethyl)carbamate
CID 63788521
(E)-4-[2-(dimethylamino)ethyl-(pyridin-3-ylmethyl)amino]-4-oxobut-2-enoic acid
CID 60951962
3-amino-4-[2-(dimethylamino)ethyl-(pyridin-3-ylmethyl)amino]-4-oxobutanoic acid
CID 64896517
1-benzyl-N-[2-(dimethylamino)ethyl]-N-(pyridin-3-ylmethyl)triazole-4-carboxamide
CID 86824246
3-amino-N-[2-(dimethylamino)ethyl]-2-methyl-N-(pyridin-3-ylmethyl)propanamide
CID 62670710

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)ethyl]-2-(1-ethylindol-3-yl)-N-(pyridin-3-ylmethyl)acetamide?
The IUPAC name of N-[2-(dimethylamino)ethyl]-2-(1-ethylindol-3-yl)-N-(pyridin-3-ylmethyl)acetamide (CID 46966320) is N-[2-(dimethylamino)ethyl]-2-(1-ethylindol-3-yl)-N-(pyridin-3-ylmethyl)acetamide.
What is the SMILES notation for N-[2-(dimethylamino)ethyl]-2-(1-ethylindol-3-yl)-N-(pyridin-3-ylmethyl)acetamide?
The canonical SMILES for N-[2-(dimethylamino)ethyl]-2-(1-ethylindol-3-yl)-N-(pyridin-3-ylmethyl)acetamide is CCn1cc(CC(=O)N(CCN(C)C)Cc2cccnc2)c2ccccc21.
What is the InChIKey of N-[2-(dimethylamino)ethyl]-2-(1-ethylindol-3-yl)-N-(pyridin-3-ylmethyl)acetamide?
The InChIKey is YWQIWGZVTSSZGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H28N4O/c1-4-25-17-19(20-9-5-6-10-21(20)25)14-22(27)26(13-12-24(2)3)16-18-8-7-11-23-15-18/h5-11,15,17H,4,12-14,16H2,1-3H3.
What are the key properties of N-[2-(dimethylamino)ethyl]-2-(1-ethylindol-3-yl)-N-(pyridin-3-ylmethyl)acetamide?
N-[2-(dimethylamino)ethyl]-2-(1-ethylindol-3-yl)-N-(pyridin-3-ylmethyl)acetamide has a molecular weight of 364.49 g/mol, XLogP of 3.19, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)ethyl]-2-(1-ethylindol-3-yl)-N-(pyridin-3-ylmethyl)acetamide is sourced from PubChem (CID 46966320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).