N-(2-hydroxypropyl)-2-(1H-indol-5-yl)acetamide

C13H16N2O2 — CID 84577469

IUPACN-(2-hydroxypropyl)-2-(1H-indol-5-yl)acetamide
SMILESCC(O)CNC(=O)Cc1ccc2[nH]ccc2c1
InChIInChI=1S/C13H16N2O2/c1-9(16)8-15-13(17)7-10-2-3-12-11(6-10)4-5-14-12/h2-6,9,14,16H,7-8H2,1H3,(H,15,17)
InChIKeyQYGINLIWSGZUBD-UHFFFAOYSA-N
MW232.28 g/mol
LogP1.21
Rot. Bonds4

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

N-(2-hydroxypropyl)-2-(1H-indol-5-yl)acetamide (PubChem CID 84577469) has the molecular formula C13H16N2O2 and a molecular weight of 232.28 g/mol. Its IUPAC name is N-(2-hydroxypropyl)-2-(1H-indol-5-yl)acetamide.

Molecular Properties

Compound NameN-(2-hydroxypropyl)-2-(1H-indol-5-yl)acetamide
PubChem CID84577469
Molecular FormulaC13H16N2O2
Molecular Weight232.28 g/mol
Exact Mass232.12
IUPAC NameN-(2-hydroxypropyl)-2-(1H-indol-5-yl)acetamide
SMILESCC(O)CNC(=O)Cc1ccc2[nH]ccc2c1
InChIInChI=1S/C13H16N2O2/c1-9(16)8-15-13(17)7-10-2-3-12-11(6-10)4-5-14-12/h2-6,9,14,16H,7-8H2,1H3,(H,15,17)
InChIKeyQYGINLIWSGZUBD-UHFFFAOYSA-N
XLogP1.21
TPSA65.12 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.28
LogP ≤ 51.21
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(2R)-2-hydroxypropyl]-2-naphthalen-2-ylacetamide
CID 83032079
methyl 2-(1H-indol-5-yl)acetate
CID 43831379
N-(2-hydroxypropyl)-2-(4-methylphenyl)acetamide
CID 43418404
N-[(2R)-2-hydroxypropyl]-2-(4-methylphenyl)acetamide
CID 83032531
2-(1H-indol-5-yl)-N-(6-methoxypyridazin-3-yl)acetamide
CID 68638504
N-cycloheptyl-2-(1H-indol-5-yl)acetamide
CID 84577573
N-[(2R)-2-hydroxypropyl]-2-(4-nitrophenyl)acetamide
CID 83058575
N-(2-hydroxypropyl)-2-(3-methoxy-4-methylphenyl)acetamide
CID 43394122
2-(1H-indol-5-yl)-N-(2-methylcyclohexyl)acetamide
CID 84577838
2-[4-(difluoromethoxy)phenyl]-N-[(2R)-2-hydroxypropyl]acetamide
CID 83031888
2-(4-hydroxyphenyl)-N-(1H-indol-5-yl)acetamide
CID 110472843
methyl (2S)-2-[3-(1H-indol-5-yl)propanoylamino]propanoate
CID 84598942

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxypropyl)-2-(1H-indol-5-yl)acetamide?
The IUPAC name of N-(2-hydroxypropyl)-2-(1H-indol-5-yl)acetamide (CID 84577469) is N-(2-hydroxypropyl)-2-(1H-indol-5-yl)acetamide.
What is the SMILES notation for N-(2-hydroxypropyl)-2-(1H-indol-5-yl)acetamide?
The canonical SMILES for N-(2-hydroxypropyl)-2-(1H-indol-5-yl)acetamide is CC(O)CNC(=O)Cc1ccc2[nH]ccc2c1.
What is the InChIKey of N-(2-hydroxypropyl)-2-(1H-indol-5-yl)acetamide?
The InChIKey is QYGINLIWSGZUBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O2/c1-9(16)8-15-13(17)7-10-2-3-12-11(6-10)4-5-14-12/h2-6,9,14,16H,7-8H2,1H3,(H,15,17).
What are the key properties of N-(2-hydroxypropyl)-2-(1H-indol-5-yl)acetamide?
N-(2-hydroxypropyl)-2-(1H-indol-5-yl)acetamide has a molecular weight of 232.28 g/mol, XLogP of 1.21, 4 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxypropyl)-2-(1H-indol-5-yl)acetamide is sourced from PubChem (CID 84577469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).