N-[2-(diethylamino)-2-thiophen-3-ylethyl]-2-(1H-indol-3-yl)acetamide

C20H25N3OS — CID 46470417

IUPACN-[2-(diethylamino)-2-thiophen-3-ylethyl]-2-(1H-indol-3-yl)acetamide
SMILESCCN(CC)C(CNC(=O)Cc1c[nH]c2ccccc12)c1ccsc1
InChIInChI=1S/C20H25N3OS/c1-3-23(4-2)19(15-9-10-25-14-15)13-22-20(24)11-16-12-21-18-8-6-5-7-17(16)18/h5-10,12,14,19,21H,3-4,11,13H2,1-2H3,(H,22,24)
InChIKeyZOBBNAQOWYYYCV-UHFFFAOYSA-N
MW355.51 g/mol
LogP3.97
Rot. Bonds8

About N-[2-(diethylamino)-2-thiophen-3-ylethyl]-2-(1H-indol-3-yl)acetamide

N-[2-(diethylamino)-2-thiophen-3-ylethyl]-2-(1H-indol-3-yl)acetamide (PubChem CID 46470417) has the molecular formula C20H25N3OS and a molecular weight of 355.51 g/mol. Its IUPAC name is N-[2-(diethylamino)-2-thiophen-3-ylethyl]-2-(1H-indol-3-yl)acetamide.

Molecular Properties

Compound NameN-[2-(diethylamino)-2-thiophen-3-ylethyl]-2-(1H-indol-3-yl)acetamide
PubChem CID46470417
Molecular FormulaC20H25N3OS
Molecular Weight355.51 g/mol
Exact Mass355.17
IUPAC NameN-[2-(diethylamino)-2-thiophen-3-ylethyl]-2-(1H-indol-3-yl)acetamide
SMILESCCN(CC)C(CNC(=O)Cc1c[nH]c2ccccc12)c1ccsc1
InChIInChI=1S/C20H25N3OS/c1-3-23(4-2)19(15-9-10-25-14-15)13-22-20(24)11-16-12-21-18-8-6-5-7-17(16)18/h5-10,12,14,19,21H,3-4,11,13H2,1-2H3,(H,22,24)
InChIKeyZOBBNAQOWYYYCV-UHFFFAOYSA-N
XLogP3.97
TPSA48.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.51
LogP ≤ 53.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2S)-2-hydroxypropyl]-2-(1H-indol-3-yl)acetamide
CID 39248120
N-[2-[ethyl(methyl)amino]-2-oxoethyl]-2-(1H-indol-3-yl)acetamide
CID 104920242
2-[[[2-(1H-indol-3-yl)acetyl]amino]methyl]-4-methylpentanoic acid
CID 119253373
N-hydroxy-2-(1H-indol-3-yl)acetamide
CID 13058633
N-[[4-[(1S)-1-hydroxyethyl]phenyl]methyl]-2-(1H-indol-3-yl)acetamide
CID 95308809
2-(1H-indol-3-yl)-N-[(1-thiophen-3-yltriazol-4-yl)methyl]acetamide
CID 122275829
N-[2-(diethylamino)-2-thiophen-3-ylethyl]-5-methyl-1-phenylpyrazole-3-carboxamide
CID 55843155
N-[(4-bromothiophen-2-yl)methyl]-2-(1H-indol-3-yl)acetamide
CID 47250258
2-(1H-indol-3-yl)-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]acetamide
CID 103775067
N-[2-(dimethylamino)-2-phenylethyl]-4-(1H-indol-3-yl)butanamide
CID 51153675
2-amino-N-[2-(diethylamino)-2-thiophen-3-ylethyl]-3-phenylpropanamide;dihydrochloride
CID 119849739
methyl 3-[[2-(1H-indol-3-yl)acetyl]amino]propanoate
CID 2539049

Frequently Asked Questions

What is the IUPAC name of N-[2-(diethylamino)-2-thiophen-3-ylethyl]-2-(1H-indol-3-yl)acetamide?
The IUPAC name of N-[2-(diethylamino)-2-thiophen-3-ylethyl]-2-(1H-indol-3-yl)acetamide (CID 46470417) is N-[2-(diethylamino)-2-thiophen-3-ylethyl]-2-(1H-indol-3-yl)acetamide.
What is the SMILES notation for N-[2-(diethylamino)-2-thiophen-3-ylethyl]-2-(1H-indol-3-yl)acetamide?
The canonical SMILES for N-[2-(diethylamino)-2-thiophen-3-ylethyl]-2-(1H-indol-3-yl)acetamide is CCN(CC)C(CNC(=O)Cc1c[nH]c2ccccc12)c1ccsc1.
What is the InChIKey of N-[2-(diethylamino)-2-thiophen-3-ylethyl]-2-(1H-indol-3-yl)acetamide?
The InChIKey is ZOBBNAQOWYYYCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3OS/c1-3-23(4-2)19(15-9-10-25-14-15)13-22-20(24)11-16-12-21-18-8-6-5-7-17(16)18/h5-10,12,14,19,21H,3-4,11,13H2,1-2H3,(H,22,24).
What are the key properties of N-[2-(diethylamino)-2-thiophen-3-ylethyl]-2-(1H-indol-3-yl)acetamide?
N-[2-(diethylamino)-2-thiophen-3-ylethyl]-2-(1H-indol-3-yl)acetamide has a molecular weight of 355.51 g/mol, XLogP of 3.97, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(diethylamino)-2-thiophen-3-ylethyl]-2-(1H-indol-3-yl)acetamide is sourced from PubChem (CID 46470417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).