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

C16H16N2OS — CID 42904642

IUPACN-[2-(1H-indol-3-yl)-2-thiophen-2-ylethyl]acetamide
SMILESCC(=O)NCC(c1cccs1)c1c[nH]c2ccccc12
InChIInChI=1S/C16H16N2OS/c1-11(19)17-10-14(16-7-4-8-20-16)13-9-18-15-6-3-2-5-12(13)15/h2-9,14,18H,10H2,1H3,(H,17,19)
InChIKeyUQGBSYXKDCFZPH-UHFFFAOYSA-N
MW284.38 g/mol
LogP3.50
Rot. Bonds4

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

N-[2-(1H-indol-3-yl)-2-thiophen-2-ylethyl]acetamide (PubChem CID 42904642) has the molecular formula C16H16N2OS and a molecular weight of 284.38 g/mol. Its IUPAC name is N-[2-(1H-indol-3-yl)-2-thiophen-2-ylethyl]acetamide.

Molecular Properties

Compound NameN-[2-(1H-indol-3-yl)-2-thiophen-2-ylethyl]acetamide
PubChem CID42904642
Molecular FormulaC16H16N2OS
Molecular Weight284.38 g/mol
Exact Mass284.10
IUPAC NameN-[2-(1H-indol-3-yl)-2-thiophen-2-ylethyl]acetamide
SMILESCC(=O)NCC(c1cccs1)c1c[nH]c2ccccc12
InChIInChI=1S/C16H16N2OS/c1-11(19)17-10-14(16-7-4-8-20-16)13-9-18-15-6-3-2-5-12(13)15/h2-9,14,18H,10H2,1H3,(H,17,19)
InChIKeyUQGBSYXKDCFZPH-UHFFFAOYSA-N
XLogP3.50
TPSA44.89 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.38
LogP ≤ 53.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(4R)-4-(1H-indol-3-yl)-4-thiophen-2-ylbutan-2-one
CID 102274489
2-(4-bromophenyl)-N-[(2R)-2-(1H-indol-3-yl)-2-thiophen-2-ylethyl]acetamide
CID 27770907
2,6-difluoro-N-[2-(1H-indol-3-yl)-2-thiophen-2-ylethyl]benzamide
CID 42904645
N-[(2R)-2-(1H-indol-3-yl)-2-thiophen-2-ylethyl]-2-methylpyrimidine-4-carboxamide
CID 97191740
N-[2-(1H-indol-3-yl)-2-thiophen-2-ylethyl]-2-(3-methylphenoxy)propanamide
CID 55329101
1-(2-fluorophenyl)-3-[2-(1H-indol-3-yl)-2-thiophen-2-ylethyl]urea
CID 24588097
N-[2-(1H-indol-3-yl)-2-thiophen-2-ylethyl]-2-(4-methylphenyl)sulfanylacetamide
CID 55329076
3-(dimethylamino)-N-[2-(1H-indol-3-yl)-2-thiophen-2-ylethyl]benzamide
CID 4858646
1-[1-(4-fluorophenyl)ethyl]-3-[2-(1H-indol-3-yl)-2-thiophen-2-ylethyl]-1-methylurea
CID 55472337
1-butyl-3-[2-(1H-indol-3-yl)-2-thiophen-2-ylethyl]thiourea
CID 42997038
N-[4-[[2-(1H-indol-3-yl)-2-thiophen-2-ylethyl]amino]-4-oxobutyl]benzamide
CID 55366766
2-ethoxy-N-[(2S)-2-(1H-indol-3-yl)-2-thiophen-2-ylethyl]pyridine-3-carboxamide
CID 9119210

Frequently Asked Questions

What is the IUPAC name of N-[2-(1H-indol-3-yl)-2-thiophen-2-ylethyl]acetamide?
The IUPAC name of N-[2-(1H-indol-3-yl)-2-thiophen-2-ylethyl]acetamide (CID 42904642) is N-[2-(1H-indol-3-yl)-2-thiophen-2-ylethyl]acetamide.
What is the SMILES notation for N-[2-(1H-indol-3-yl)-2-thiophen-2-ylethyl]acetamide?
The canonical SMILES for N-[2-(1H-indol-3-yl)-2-thiophen-2-ylethyl]acetamide is CC(=O)NCC(c1cccs1)c1c[nH]c2ccccc12.
What is the InChIKey of N-[2-(1H-indol-3-yl)-2-thiophen-2-ylethyl]acetamide?
The InChIKey is UQGBSYXKDCFZPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2OS/c1-11(19)17-10-14(16-7-4-8-20-16)13-9-18-15-6-3-2-5-12(13)15/h2-9,14,18H,10H2,1H3,(H,17,19).
What are the key properties of N-[2-(1H-indol-3-yl)-2-thiophen-2-ylethyl]acetamide?
N-[2-(1H-indol-3-yl)-2-thiophen-2-ylethyl]acetamide has a molecular weight of 284.38 g/mol, XLogP of 3.50, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1H-indol-3-yl)-2-thiophen-2-ylethyl]acetamide is sourced from PubChem (CID 42904642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).