N-(1H-indol-5-yl)-2-(oxetan-3-yl)acetamide

C13H14N2O2 — CID 112526005

IUPACN-(1H-indol-5-yl)-2-(oxetan-3-yl)acetamide
SMILESO=C(CC1COC1)Nc1ccc2[nH]ccc2c1
InChIInChI=1S/C13H14N2O2/c16-13(5-9-7-17-8-9)15-11-1-2-12-10(6-11)3-4-14-12/h1-4,6,9,14H,5,7-8H2,(H,15,16)
InChIKeyYRZPLPBQOSUTAA-UHFFFAOYSA-N
MW230.27 g/mol
LogP2.14
Rot. Bonds3

About N-(1H-indol-5-yl)-2-(oxetan-3-yl)acetamide

N-(1H-indol-5-yl)-2-(oxetan-3-yl)acetamide (PubChem CID 112526005) has the molecular formula C13H14N2O2 and a molecular weight of 230.27 g/mol. Its IUPAC name is N-(1H-indol-5-yl)-2-(oxetan-3-yl)acetamide.

Molecular Properties

Compound NameN-(1H-indol-5-yl)-2-(oxetan-3-yl)acetamide
PubChem CID112526005
Molecular FormulaC13H14N2O2
Molecular Weight230.27 g/mol
Exact Mass230.11
IUPAC NameN-(1H-indol-5-yl)-2-(oxetan-3-yl)acetamide
SMILESO=C(CC1COC1)Nc1ccc2[nH]ccc2c1
InChIInChI=1S/C13H14N2O2/c16-13(5-9-7-17-8-9)15-11-1-2-12-10(6-11)3-4-14-12/h1-4,6,9,14H,5,7-8H2,(H,15,16)
InChIKeyYRZPLPBQOSUTAA-UHFFFAOYSA-N
XLogP2.14
TPSA54.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.27
LogP ≤ 52.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-(1H-indol-5-ylamino)-4-oxobutanoic acid
CID 54867490
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2-(1,1-dioxo-1,4-thiazinan-3-yl)-N-(1H-indol-5-yl)acetamide
CID 80518373
[(2R)-oxiran-2-yl]methyl N-(1H-indol-5-yl)carbamate
CID 57343440
2-(4-hydroxyphenyl)-N-(1H-indol-5-yl)acetamide
CID 110472843
2-(1-aminocyclopentyl)-N-(1H-indol-5-yl)acetamide
CID 64679206
1-[2-(1H-indol-5-ylamino)-2-oxoethyl]cyclopentane-1-carboxylic acid
CID 60941797
N-(1H-indol-5-yl)-2-[(5S)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-yl]acetamide
CID 93020330
N-(1H-indol-5-yl)-3-oxo-3-phenylpropanamide
CID 110473206
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CID 64679208
2-(oxetan-3-yl)-N-[4-(trifluoromethyl)phenyl]acetamide
CID 84575366
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CID 120974701

Frequently Asked Questions

What is the IUPAC name of N-(1H-indol-5-yl)-2-(oxetan-3-yl)acetamide?
The IUPAC name of N-(1H-indol-5-yl)-2-(oxetan-3-yl)acetamide (CID 112526005) is N-(1H-indol-5-yl)-2-(oxetan-3-yl)acetamide.
What is the SMILES notation for N-(1H-indol-5-yl)-2-(oxetan-3-yl)acetamide?
The canonical SMILES for N-(1H-indol-5-yl)-2-(oxetan-3-yl)acetamide is O=C(CC1COC1)Nc1ccc2[nH]ccc2c1.
What is the InChIKey of N-(1H-indol-5-yl)-2-(oxetan-3-yl)acetamide?
The InChIKey is YRZPLPBQOSUTAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O2/c16-13(5-9-7-17-8-9)15-11-1-2-12-10(6-11)3-4-14-12/h1-4,6,9,14H,5,7-8H2,(H,15,16).
What are the key properties of N-(1H-indol-5-yl)-2-(oxetan-3-yl)acetamide?
N-(1H-indol-5-yl)-2-(oxetan-3-yl)acetamide has a molecular weight of 230.27 g/mol, XLogP of 2.14, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-indol-5-yl)-2-(oxetan-3-yl)acetamide is sourced from PubChem (CID 112526005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).