N-(2-phenylethyl)-1H-indole-2-carboxamide

C17H16N2O — CID 12627221

IUPACN-(2-phenylethyl)-1H-indole-2-carboxamide
SMILESO=C(NCCc1ccccc1)c1cc2ccccc2[nH]1
InChIInChI=1S/C17H16N2O/c20-17(18-11-10-13-6-2-1-3-7-13)16-12-14-8-4-5-9-15(14)19-16/h1-9,12,19H,10-11H2,(H,18,20)
InChIKeyLANZFLJGXZCWQM-UHFFFAOYSA-N
MW264.33 g/mol
LogP3.14
Rot. Bonds4

About N-(2-phenylethyl)-1H-indole-2-carboxamide

N-(2-phenylethyl)-1H-indole-2-carboxamide (PubChem CID 12627221) has the molecular formula C17H16N2O and a molecular weight of 264.33 g/mol. Its IUPAC name is N-(2-phenylethyl)-1H-indole-2-carboxamide.

Molecular Properties

Compound NameN-(2-phenylethyl)-1H-indole-2-carboxamide
PubChem CID12627221
Molecular FormulaC17H16N2O
Molecular Weight264.33 g/mol
Exact Mass264.13
IUPAC NameN-(2-phenylethyl)-1H-indole-2-carboxamide
SMILESO=C(NCCc1ccccc1)c1cc2ccccc2[nH]1
InChIInChI=1S/C17H16N2O/c20-17(18-11-10-13-6-2-1-3-7-13)16-12-14-8-4-5-9-15(14)19-16/h1-9,12,19H,10-11H2,(H,18,20)
InChIKeyLANZFLJGXZCWQM-UHFFFAOYSA-N
XLogP3.14
TPSA44.89 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 53.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-(2-phenylethyl)-1H-indole-2-carboxamide?
The IUPAC name of N-(2-phenylethyl)-1H-indole-2-carboxamide (CID 12627221) is N-(2-phenylethyl)-1H-indole-2-carboxamide.
What is the SMILES notation for N-(2-phenylethyl)-1H-indole-2-carboxamide?
The canonical SMILES for N-(2-phenylethyl)-1H-indole-2-carboxamide is O=C(NCCc1ccccc1)c1cc2ccccc2[nH]1.
What is the InChIKey of N-(2-phenylethyl)-1H-indole-2-carboxamide?
The InChIKey is LANZFLJGXZCWQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O/c20-17(18-11-10-13-6-2-1-3-7-13)16-12-14-8-4-5-9-15(14)19-16/h1-9,12,19H,10-11H2,(H,18,20).
What are the key properties of N-(2-phenylethyl)-1H-indole-2-carboxamide?
N-(2-phenylethyl)-1H-indole-2-carboxamide has a molecular weight of 264.33 g/mol, XLogP of 3.14, 4 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-phenylethyl)-1H-indole-2-carboxamide is sourced from PubChem (CID 12627221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).