N-(4-chloro-2-pyrrol-1-ylphenyl)-2-phenylacetamide

C18H15ClN2O — CID 56582364

IUPACN-(4-chloro-2-pyrrol-1-ylphenyl)-2-phenylacetamide
SMILESO=C(Cc1ccccc1)Nc1ccc(Cl)cc1-n1cccc1
InChIInChI=1S/C18H15ClN2O/c19-15-8-9-16(17(13-15)21-10-4-5-11-21)20-18(22)12-14-6-2-1-3-7-14/h1-11,13H,12H2,(H,20,22)
InChIKeyBXRURHJGUBRXHN-UHFFFAOYSA-N
MW310.78 g/mol
LogP4.31
Rot. Bonds4

About N-(4-chloro-2-pyrrol-1-ylphenyl)-2-phenylacetamide

N-(4-chloro-2-pyrrol-1-ylphenyl)-2-phenylacetamide (PubChem CID 56582364) has the molecular formula C18H15ClN2O and a molecular weight of 310.78 g/mol. Its IUPAC name is N-(4-chloro-2-pyrrol-1-ylphenyl)-2-phenylacetamide.

Molecular Properties

Compound NameN-(4-chloro-2-pyrrol-1-ylphenyl)-2-phenylacetamide
PubChem CID56582364
Molecular FormulaC18H15ClN2O
Molecular Weight310.78 g/mol
Exact Mass310.09
IUPAC NameN-(4-chloro-2-pyrrol-1-ylphenyl)-2-phenylacetamide
SMILESO=C(Cc1ccccc1)Nc1ccc(Cl)cc1-n1cccc1
InChIInChI=1S/C18H15ClN2O/c19-15-8-9-16(17(13-15)21-10-4-5-11-21)20-18(22)12-14-6-2-1-3-7-14/h1-11,13H,12H2,(H,20,22)
InChIKeyBXRURHJGUBRXHN-UHFFFAOYSA-N
XLogP4.31
TPSA34.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.78
LogP ≤ 54.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(4-chloro-2-pyrrol-1-ylphenyl)-2-phenylacetamide 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

N-(4-chloro-2-pyrrol-1-ylphenyl)-2-(4-nitrophenyl)acetamide
CID 56535926
N-(4-chloro-2-pyrrol-1-ylphenyl)pentanamide
CID 56530685
N-(2-amino-5-chlorophenyl)-2-phenylacetamide
CID 18071244
4-chloro-2-[(2-phenylacetyl)amino]benzoic acid
CID 3880553
N-(4-chloro-2-pyrrol-1-ylphenyl)-4-ethoxybutanamide
CID 56530387
N-(5-chloro-2-pyrrolidin-1-ylphenyl)-2-phenylacetamide
CID 7406867
N-(4-chloro-2-pyrrol-1-ylphenyl)-2-(2-cyanophenoxy)acetamide
CID 56583342
N-(4-chloro-2-pyrrol-1-ylphenyl)-4-oxo-4-(5-phenyl-3,4-dihydropyrazol-2-yl)butanamide
CID 56530291
4-chloro-N-(4-chloro-2-pyrrol-1-ylphenyl)pyridine-2-carboxamide
CID 56530341
N-(4-chloro-2-pyrrol-1-ylphenyl)-3-(3,5-dimethylpyrazol-1-yl)propanamide
CID 56582587
N-(4-chloro-2-morpholin-4-ylphenyl)-3-phenylpropanamide
CID 2990376
N-(4-chloro-2-pyrrol-1-ylphenyl)-2-methoxybenzamide
CID 56530750

Frequently Asked Questions

What is the IUPAC name of N-(4-chloro-2-pyrrol-1-ylphenyl)-2-phenylacetamide?
The IUPAC name of N-(4-chloro-2-pyrrol-1-ylphenyl)-2-phenylacetamide (CID 56582364) is N-(4-chloro-2-pyrrol-1-ylphenyl)-2-phenylacetamide.
What is the SMILES notation for N-(4-chloro-2-pyrrol-1-ylphenyl)-2-phenylacetamide?
The canonical SMILES for N-(4-chloro-2-pyrrol-1-ylphenyl)-2-phenylacetamide is O=C(Cc1ccccc1)Nc1ccc(Cl)cc1-n1cccc1.
What is the InChIKey of N-(4-chloro-2-pyrrol-1-ylphenyl)-2-phenylacetamide?
The InChIKey is BXRURHJGUBRXHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15ClN2O/c19-15-8-9-16(17(13-15)21-10-4-5-11-21)20-18(22)12-14-6-2-1-3-7-14/h1-11,13H,12H2,(H,20,22).
What are the key properties of N-(4-chloro-2-pyrrol-1-ylphenyl)-2-phenylacetamide?
N-(4-chloro-2-pyrrol-1-ylphenyl)-2-phenylacetamide has a molecular weight of 310.78 g/mol, XLogP of 4.31, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chloro-2-pyrrol-1-ylphenyl)-2-phenylacetamide is sourced from PubChem (CID 56582364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).