N-(2-phenylethyl)-2-pyrrol-1-ylpropanamide

C15H18N2O — CID 17086628

IUPACN-(2-phenylethyl)-2-pyrrol-1-ylpropanamide
SMILESCC(C(=O)NCCc1ccccc1)n1cccc1
InChIInChI=1S/C15H18N2O/c1-13(17-11-5-6-12-17)15(18)16-10-9-14-7-3-2-4-8-14/h2-8,11-13H,9-10H2,1H3,(H,16,18)
InChIKeyRHHZUASBPNMYIN-UHFFFAOYSA-N
MW242.32 g/mol
LogP2.41
Rot. Bonds5

About N-(2-phenylethyl)-2-pyrrol-1-ylpropanamide

N-(2-phenylethyl)-2-pyrrol-1-ylpropanamide (PubChem CID 17086628) has the molecular formula C15H18N2O and a molecular weight of 242.32 g/mol. Its IUPAC name is N-(2-phenylethyl)-2-pyrrol-1-ylpropanamide.

Molecular Properties

Compound NameN-(2-phenylethyl)-2-pyrrol-1-ylpropanamide
PubChem CID17086628
Molecular FormulaC15H18N2O
Molecular Weight242.32 g/mol
Exact Mass242.14
IUPAC NameN-(2-phenylethyl)-2-pyrrol-1-ylpropanamide
SMILESCC(C(=O)NCCc1ccccc1)n1cccc1
InChIInChI=1S/C15H18N2O/c1-13(17-11-5-6-12-17)15(18)16-10-9-14-7-3-2-4-8-14/h2-8,11-13H,9-10H2,1H3,(H,16,18)
InChIKeyRHHZUASBPNMYIN-UHFFFAOYSA-N
XLogP2.41
TPSA34.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(2-phenylethyl)-2-pyrrol-1-ylpropanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(3-formylpyrrol-1-yl)-N-(2-phenylethyl)propanamide
CID 57188054
2-methyl-N-(2-phenylethyl)propanamide;dihydrochloride
CID 174557988
(2R)-2-(4-benzylpiperazin-1-yl)-N-(2-phenylethyl)propanamide
CID 1439293
N-[2-(4-hydroxyphenyl)ethyl]-2-phenyl-2-pyrrol-1-ylacetamide
CID 121240272
(2S)-2-acetamido-N-(2-phenylethyl)propanamide
CID 51647688
(2S)-2-hydroxy-2-phenyl-N-(2-phenylethyl)acetamide
CID 26793852
N-ethyl-2-pyrrol-1-ylpropanamide
CID 61478012
1-[(2S)-1-oxo-1-(2-phenylethylamino)propan-2-yl]piperidine-4-carboxamide
CID 9443521
N-(4-phenylbutyl)-2-pyrazol-1-ylpropanamide
CID 119059945
(2S)-2-bromo-N-(2-phenylethyl)butanamide
CID 51659927
2-[(3S,4R)-3-amino-4-phenylpyrrolidin-1-yl]-N-(2-phenylethyl)propanamide;hydrochloride
CID 120760797
ethyl 4-[(2R)-1-oxo-1-(2-phenylethylamino)propan-2-yl]piperazine-1-carboxylate
CID 9431113

Frequently Asked Questions

What is the IUPAC name of N-(2-phenylethyl)-2-pyrrol-1-ylpropanamide?
The IUPAC name of N-(2-phenylethyl)-2-pyrrol-1-ylpropanamide (CID 17086628) is N-(2-phenylethyl)-2-pyrrol-1-ylpropanamide.
What is the SMILES notation for N-(2-phenylethyl)-2-pyrrol-1-ylpropanamide?
The canonical SMILES for N-(2-phenylethyl)-2-pyrrol-1-ylpropanamide is CC(C(=O)NCCc1ccccc1)n1cccc1.
What is the InChIKey of N-(2-phenylethyl)-2-pyrrol-1-ylpropanamide?
The InChIKey is RHHZUASBPNMYIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O/c1-13(17-11-5-6-12-17)15(18)16-10-9-14-7-3-2-4-8-14/h2-8,11-13H,9-10H2,1H3,(H,16,18).
What are the key properties of N-(2-phenylethyl)-2-pyrrol-1-ylpropanamide?
N-(2-phenylethyl)-2-pyrrol-1-ylpropanamide has a molecular weight of 242.32 g/mol, XLogP of 2.41, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-phenylethyl)-2-pyrrol-1-ylpropanamide is sourced from PubChem (CID 17086628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).