N-(4-chlorophenyl)-N-(1H-indol-3-yl)acetamide

C16H13ClN2O — CID 808156

IUPACN-(4-chlorophenyl)-N-(1H-indol-3-yl)acetamide
SMILESCC(=O)N(c1ccc(Cl)cc1)c1c[nH]c2ccccc12
InChIInChI=1S/C16H13ClN2O/c1-11(20)19(13-8-6-12(17)7-9-13)16-10-18-15-5-3-2-4-14(15)16/h2-10,18H,1H3
InChIKeyCPZQDNHYJMCZHI-UHFFFAOYSA-N
MW284.75 g/mol
LogP4.51
Rot. Bonds2

About N-(4-chlorophenyl)-N-(1H-indol-3-yl)acetamide

N-(4-chlorophenyl)-N-(1H-indol-3-yl)acetamide (PubChem CID 808156) has the molecular formula C16H13ClN2O and a molecular weight of 284.75 g/mol. Its IUPAC name is N-(4-chlorophenyl)-N-(1H-indol-3-yl)acetamide.

Molecular Properties

Compound NameN-(4-chlorophenyl)-N-(1H-indol-3-yl)acetamide
PubChem CID808156
Molecular FormulaC16H13ClN2O
Molecular Weight284.75 g/mol
Exact Mass284.07
IUPAC NameN-(4-chlorophenyl)-N-(1H-indol-3-yl)acetamide
SMILESCC(=O)N(c1ccc(Cl)cc1)c1c[nH]c2ccccc12
InChIInChI=1S/C16H13ClN2O/c1-11(20)19(13-8-6-12(17)7-9-13)16-10-18-15-5-3-2-4-14(15)16/h2-10,18H,1H3
InChIKeyCPZQDNHYJMCZHI-UHFFFAOYSA-N
XLogP4.51
TPSA36.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.75
LogP ≤ 54.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-(4-chlorophenyl)-N-(1H-indol-3-yl)acetamide?
The IUPAC name of N-(4-chlorophenyl)-N-(1H-indol-3-yl)acetamide (CID 808156) is N-(4-chlorophenyl)-N-(1H-indol-3-yl)acetamide.
What is the SMILES notation for N-(4-chlorophenyl)-N-(1H-indol-3-yl)acetamide?
The canonical SMILES for N-(4-chlorophenyl)-N-(1H-indol-3-yl)acetamide is CC(=O)N(c1ccc(Cl)cc1)c1c[nH]c2ccccc12.
What is the InChIKey of N-(4-chlorophenyl)-N-(1H-indol-3-yl)acetamide?
The InChIKey is CPZQDNHYJMCZHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13ClN2O/c1-11(20)19(13-8-6-12(17)7-9-13)16-10-18-15-5-3-2-4-14(15)16/h2-10,18H,1H3.
What are the key properties of N-(4-chlorophenyl)-N-(1H-indol-3-yl)acetamide?
N-(4-chlorophenyl)-N-(1H-indol-3-yl)acetamide has a molecular weight of 284.75 g/mol, XLogP of 4.51, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chlorophenyl)-N-(1H-indol-3-yl)acetamide is sourced from PubChem (CID 808156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).