N-[(4-chlorophenyl)methyl]-2-(2,3-dihydroindol-1-yl)acetamide

C17H17ClN2O — CID 2654337

IUPACN-[(4-chlorophenyl)methyl]-2-(2,3-dihydroindol-1-yl)acetamide
SMILESO=C(CN1CCc2ccccc21)NCc1ccc(Cl)cc1
InChIInChI=1S/C17H17ClN2O/c18-15-7-5-13(6-8-15)11-19-17(21)12-20-10-9-14-3-1-2-4-16(14)20/h1-8H,9-12H2,(H,19,21)
InChIKeyFEHXAEMXFCXTGW-UHFFFAOYSA-N
MW300.79 g/mol
LogP3.02
Rot. Bonds4

About N-[(4-chlorophenyl)methyl]-2-(2,3-dihydroindol-1-yl)acetamide

N-[(4-chlorophenyl)methyl]-2-(2,3-dihydroindol-1-yl)acetamide (PubChem CID 2654337) has the molecular formula C17H17ClN2O and a molecular weight of 300.79 g/mol. Its IUPAC name is N-[(4-chlorophenyl)methyl]-2-(2,3-dihydroindol-1-yl)acetamide.

Molecular Properties

Compound NameN-[(4-chlorophenyl)methyl]-2-(2,3-dihydroindol-1-yl)acetamide
PubChem CID2654337
Molecular FormulaC17H17ClN2O
Molecular Weight300.79 g/mol
Exact Mass300.10
IUPAC NameN-[(4-chlorophenyl)methyl]-2-(2,3-dihydroindol-1-yl)acetamide
SMILESO=C(CN1CCc2ccccc21)NCc1ccc(Cl)cc1
InChIInChI=1S/C17H17ClN2O/c18-15-7-5-13(6-8-15)11-19-17(21)12-20-10-9-14-3-1-2-4-16(14)20/h1-8H,9-12H2,(H,19,21)
InChIKeyFEHXAEMXFCXTGW-UHFFFAOYSA-N
XLogP3.02
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.79
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2,3-dihydroindol-1-yl)-N-(pyridin-4-ylmethyl)acetamide
CID 47389879
N-[2-(4-chlorophenyl)ethyl]-2-(3,4-dihydro-2H-quinolin-1-yl)acetamide
CID 2548635
2-(2,3-dihydroindol-1-yl)-N-[(3,4-dimethoxyphenyl)methyl]acetamide
CID 8704444
2-[[2-(2,3-dihydroindol-1-yl)acetyl]amino]acetic acid
CID 82041294
N-[[4-[[2-(2,3-dihydroindol-1-yl)acetyl]amino]phenyl]methyl]azetidine-1-carboxamide
CID 75461838
3-(4-chlorophenyl)-N'-[2-(3,4-dihydro-2H-quinolin-1-yl)acetyl]propanehydrazide
CID 24554708
2-(4-benzyl-2,3-dioxopiperazin-1-yl)-N-[(4-chlorophenyl)methyl]acetamide
CID 53041860
N-[(4-chlorophenyl)methyl]-2-[4-(2,3-dihydroindol-1-ylsulfonyl)imidazol-1-yl]acetamide
CID 20949902
N-(4-chloro-2-methylphenyl)-2-(2,3-dihydroindol-1-yl)acetamide
CID 109007270
N-[[4-(2,3-dihydroindol-1-ylmethyl)phenyl]methyl]-2-[(4-methylphenyl)methylcarbamoylamino]acetamide
CID 55678782
N-[(4-chlorophenyl)methyl]-3-(2,3-dihydroindol-1-yl)propan-1-amine
CID 29275975
2-(2,3-dihydroindol-1-yl)-N-phenylacetamide
CID 22199878

Frequently Asked Questions

What is the IUPAC name of N-[(4-chlorophenyl)methyl]-2-(2,3-dihydroindol-1-yl)acetamide?
The IUPAC name of N-[(4-chlorophenyl)methyl]-2-(2,3-dihydroindol-1-yl)acetamide (CID 2654337) is N-[(4-chlorophenyl)methyl]-2-(2,3-dihydroindol-1-yl)acetamide.
What is the SMILES notation for N-[(4-chlorophenyl)methyl]-2-(2,3-dihydroindol-1-yl)acetamide?
The canonical SMILES for N-[(4-chlorophenyl)methyl]-2-(2,3-dihydroindol-1-yl)acetamide is O=C(CN1CCc2ccccc21)NCc1ccc(Cl)cc1.
What is the InChIKey of N-[(4-chlorophenyl)methyl]-2-(2,3-dihydroindol-1-yl)acetamide?
The InChIKey is FEHXAEMXFCXTGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17ClN2O/c18-15-7-5-13(6-8-15)11-19-17(21)12-20-10-9-14-3-1-2-4-16(14)20/h1-8H,9-12H2,(H,19,21).
What are the key properties of N-[(4-chlorophenyl)methyl]-2-(2,3-dihydroindol-1-yl)acetamide?
N-[(4-chlorophenyl)methyl]-2-(2,3-dihydroindol-1-yl)acetamide has a molecular weight of 300.79 g/mol, XLogP of 3.02, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-chlorophenyl)methyl]-2-(2,3-dihydroindol-1-yl)acetamide is sourced from PubChem (CID 2654337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).