2-(2,3-dihydro-1H-indol-3-yl)-N-[(4-hydroxyphenyl)methyl]acetamide

C17H18N2O2 — CID 114332228

IUPAC2-(2,3-dihydro-1H-indol-3-yl)-N-[(4-hydroxyphenyl)methyl]acetamide
SMILESO=C(CC1CNc2ccccc21)NCc1ccc(O)cc1
InChIInChI=1S/C17H18N2O2/c20-14-7-5-12(6-8-14)10-19-17(21)9-13-11-18-16-4-2-1-3-15(13)16/h1-8,13,18,20H,9-11H2,(H,19,21)
InChIKeyAQDOTXJXKPFTMS-UHFFFAOYSA-N
MW282.34 g/mol
LogP2.61
Rot. Bonds4

About 2-(2,3-dihydro-1H-indol-3-yl)-N-[(4-hydroxyphenyl)methyl]acetamide

2-(2,3-dihydro-1H-indol-3-yl)-N-[(4-hydroxyphenyl)methyl]acetamide (PubChem CID 114332228) has the molecular formula C17H18N2O2 and a molecular weight of 282.34 g/mol. Its IUPAC name is 2-(2,3-dihydro-1H-indol-3-yl)-N-[(4-hydroxyphenyl)methyl]acetamide.

Molecular Properties

Compound Name2-(2,3-dihydro-1H-indol-3-yl)-N-[(4-hydroxyphenyl)methyl]acetamide
PubChem CID114332228
Molecular FormulaC17H18N2O2
Molecular Weight282.34 g/mol
Exact Mass282.14
IUPAC Name2-(2,3-dihydro-1H-indol-3-yl)-N-[(4-hydroxyphenyl)methyl]acetamide
SMILESO=C(CC1CNc2ccccc21)NCc1ccc(O)cc1
InChIInChI=1S/C17H18N2O2/c20-14-7-5-12(6-8-14)10-19-17(21)9-13-11-18-16-4-2-1-3-15(13)16/h1-8,13,18,20H,9-11H2,(H,19,21)
InChIKeyAQDOTXJXKPFTMS-UHFFFAOYSA-N
XLogP2.61
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.34
LogP ≤ 52.61
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(4-chlorophenyl)methyl]-2-(2,3-dihydro-1H-indol-3-yl)acetamide
CID 80571757
2-(2,3-dihydro-1H-indol-3-yl)-N-(pyridin-4-ylmethyl)acetamide
CID 80573900
2-[[2-(2,3-dihydro-1H-indol-3-yl)acetyl]amino]acetic acid
CID 80573099
N-(cyclopropylmethyl)-2-(2,3-dihydro-1H-indol-3-yl)acetamide
CID 80573936
N-(2-chloroprop-2-enyl)-2-(2,3-dihydro-1H-indol-3-yl)acetamide
CID 113464669
N-(cyanomethyl)-2-(2,3-dihydro-1H-indol-3-yl)acetamide
CID 80573201
2-(2,3-dihydro-1H-indol-3-yl)-N-(1H-1,2,4-triazol-5-ylmethyl)acetamide
CID 80573115
N-(2-cyclopropylethyl)-2-(2,3-dihydro-1H-indol-3-yl)acetamide
CID 80573388
2-(2,3-dihydro-1H-indol-3-yl)-N-(2-pyridin-4-ylethyl)acetamide
CID 80572253
2-(2,3-dihydro-1H-indol-3-yl)-N-(1,2,4-oxadiazol-3-ylmethyl)acetamide
CID 106396930
2-(2,3-dihydro-1H-indol-3-yl)-N-pentylacetamide
CID 80573792
2-(2,3-dihydro-1H-indol-3-yl)-N-(2-pyrrol-1-ylethyl)acetamide
CID 106390914

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dihydro-1H-indol-3-yl)-N-[(4-hydroxyphenyl)methyl]acetamide?
The IUPAC name of 2-(2,3-dihydro-1H-indol-3-yl)-N-[(4-hydroxyphenyl)methyl]acetamide (CID 114332228) is 2-(2,3-dihydro-1H-indol-3-yl)-N-[(4-hydroxyphenyl)methyl]acetamide.
What is the SMILES notation for 2-(2,3-dihydro-1H-indol-3-yl)-N-[(4-hydroxyphenyl)methyl]acetamide?
The canonical SMILES for 2-(2,3-dihydro-1H-indol-3-yl)-N-[(4-hydroxyphenyl)methyl]acetamide is O=C(CC1CNc2ccccc21)NCc1ccc(O)cc1.
What is the InChIKey of 2-(2,3-dihydro-1H-indol-3-yl)-N-[(4-hydroxyphenyl)methyl]acetamide?
The InChIKey is AQDOTXJXKPFTMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O2/c20-14-7-5-12(6-8-14)10-19-17(21)9-13-11-18-16-4-2-1-3-15(13)16/h1-8,13,18,20H,9-11H2,(H,19,21).
What are the key properties of 2-(2,3-dihydro-1H-indol-3-yl)-N-[(4-hydroxyphenyl)methyl]acetamide?
2-(2,3-dihydro-1H-indol-3-yl)-N-[(4-hydroxyphenyl)methyl]acetamide has a molecular weight of 282.34 g/mol, XLogP of 2.61, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dihydro-1H-indol-3-yl)-N-[(4-hydroxyphenyl)methyl]acetamide is sourced from PubChem (CID 114332228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).