N-[3-(3-phenyl-1H-indol-2-yl)propyl]acetamide

C19H20N2O — CID 71418732

IUPACN-[3-(3-phenyl-1H-indol-2-yl)propyl]acetamide
SMILESCC(=O)NCCCc1[nH]c2ccccc2c1-c1ccccc1
InChIInChI=1S/C19H20N2O/c1-14(22)20-13-7-12-18-19(15-8-3-2-4-9-15)16-10-5-6-11-17(16)21-18/h2-6,8-11,21H,7,12-13H2,1H3,(H,20,22)
InChIKeyRDNPCEKWPMVPFJ-UHFFFAOYSA-N
MW292.38 g/mol
LogP3.90
Rot. Bonds5

About N-[3-(3-phenyl-1H-indol-2-yl)propyl]acetamide

N-[3-(3-phenyl-1H-indol-2-yl)propyl]acetamide (PubChem CID 71418732) has the molecular formula C19H20N2O and a molecular weight of 292.38 g/mol. Its IUPAC name is N-[3-(3-phenyl-1H-indol-2-yl)propyl]acetamide.

Molecular Properties

Compound NameN-[3-(3-phenyl-1H-indol-2-yl)propyl]acetamide
PubChem CID71418732
Molecular FormulaC19H20N2O
Molecular Weight292.38 g/mol
Exact Mass292.16
IUPAC NameN-[3-(3-phenyl-1H-indol-2-yl)propyl]acetamide
SMILESCC(=O)NCCCc1[nH]c2ccccc2c1-c1ccccc1
InChIInChI=1S/C19H20N2O/c1-14(22)20-13-7-12-18-19(15-8-3-2-4-9-15)16-10-5-6-11-17(16)21-18/h2-6,8-11,21H,7,12-13H2,1H3,(H,20,22)
InChIKeyRDNPCEKWPMVPFJ-UHFFFAOYSA-N
XLogP3.90
TPSA44.89 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 53.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[3-(3-phenyl-1H-indol-2-yl)propyl]acetamide?
The IUPAC name of N-[3-(3-phenyl-1H-indol-2-yl)propyl]acetamide (CID 71418732) is N-[3-(3-phenyl-1H-indol-2-yl)propyl]acetamide.
What is the SMILES notation for N-[3-(3-phenyl-1H-indol-2-yl)propyl]acetamide?
The canonical SMILES for N-[3-(3-phenyl-1H-indol-2-yl)propyl]acetamide is CC(=O)NCCCc1[nH]c2ccccc2c1-c1ccccc1.
What is the InChIKey of N-[3-(3-phenyl-1H-indol-2-yl)propyl]acetamide?
The InChIKey is RDNPCEKWPMVPFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O/c1-14(22)20-13-7-12-18-19(15-8-3-2-4-9-15)16-10-5-6-11-17(16)21-18/h2-6,8-11,21H,7,12-13H2,1H3,(H,20,22).
What are the key properties of N-[3-(3-phenyl-1H-indol-2-yl)propyl]acetamide?
N-[3-(3-phenyl-1H-indol-2-yl)propyl]acetamide has a molecular weight of 292.38 g/mol, XLogP of 3.90, 5 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(3-phenyl-1H-indol-2-yl)propyl]acetamide is sourced from PubChem (CID 71418732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).