N-(3,5-dichlorophenyl)-2-pyrrol-1-ylacetamide

C12H10Cl2N2O — CID 110688645

IUPACN-(3,5-dichlorophenyl)-2-pyrrol-1-ylacetamide
SMILESO=C(Cn1cccc1)Nc1cc(Cl)cc(Cl)c1
InChIInChI=1S/C12H10Cl2N2O/c13-9-5-10(14)7-11(6-9)15-12(17)8-16-3-1-2-4-16/h1-7H,8H2,(H,15,17)
InChIKeyMXJYLVBFJZYVPI-UHFFFAOYSA-N
MW269.13 g/mol
LogP3.43
Rot. Bonds3

About N-(3,5-dichlorophenyl)-2-pyrrol-1-ylacetamide

N-(3,5-dichlorophenyl)-2-pyrrol-1-ylacetamide (PubChem CID 110688645) has the molecular formula C12H10Cl2N2O and a molecular weight of 269.13 g/mol. Its IUPAC name is N-(3,5-dichlorophenyl)-2-pyrrol-1-ylacetamide.

Molecular Properties

Compound NameN-(3,5-dichlorophenyl)-2-pyrrol-1-ylacetamide
PubChem CID110688645
Molecular FormulaC12H10Cl2N2O
Molecular Weight269.13 g/mol
Exact Mass268.02
IUPAC NameN-(3,5-dichlorophenyl)-2-pyrrol-1-ylacetamide
SMILESO=C(Cn1cccc1)Nc1cc(Cl)cc(Cl)c1
InChIInChI=1S/C12H10Cl2N2O/c13-9-5-10(14)7-11(6-9)15-12(17)8-16-3-1-2-4-16/h1-7H,8H2,(H,15,17)
InChIKeyMXJYLVBFJZYVPI-UHFFFAOYSA-N
XLogP3.43
TPSA34.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.13
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,5-dichlorophenyl)-2-pyrrol-1-ylacetamide
CID 110688644
N-(3,5-dichlorophenyl)-2-(1,3-dihydroisoindol-2-yl)acetamide
CID 126213434
1-[2-(3,5-dichloroanilino)-2-oxoethyl]pyrrole-2-carboxylic acid
CID 79325609
1-[2-(3,5-dichloroanilino)-2-oxoethyl]-2-oxopyridine-3-carboxylic acid
CID 82107997
N-(3,5-dichlorophenyl)-2-morpholin-4-ylacetamide
CID 717337
N-(3,5-dichlorophenyl)-2-(3,5-dichloro-1,2,4-triazol-1-yl)acetamide
CID 9420853
N-(3,5-dichlorophenyl)-2-(2,3-dimethylimidazol-3-ium-1-yl)acetamide
CID 87584759
3-bromo-N-(3,5-dichlorophenyl)propanamide
CID 112698581
2-[(3aS,7aR)-1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl]-N-(3,5-dichlorophenyl)acetamide
CID 7952336
N-(3,5-dichlorophenyl)-2-(2-oxopiperidin-1-yl)acetamide
CID 110689887
N-(3,5-dichlorophenyl)-2-(4-propylpiperazin-1-yl)acetamide
CID 6468812
2-[2-(3,5-dichloroanilino)-2-oxoethoxy]acetic acid
CID 2732298

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dichlorophenyl)-2-pyrrol-1-ylacetamide?
The IUPAC name of N-(3,5-dichlorophenyl)-2-pyrrol-1-ylacetamide (CID 110688645) is N-(3,5-dichlorophenyl)-2-pyrrol-1-ylacetamide.
What is the SMILES notation for N-(3,5-dichlorophenyl)-2-pyrrol-1-ylacetamide?
The canonical SMILES for N-(3,5-dichlorophenyl)-2-pyrrol-1-ylacetamide is O=C(Cn1cccc1)Nc1cc(Cl)cc(Cl)c1.
What is the InChIKey of N-(3,5-dichlorophenyl)-2-pyrrol-1-ylacetamide?
The InChIKey is MXJYLVBFJZYVPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10Cl2N2O/c13-9-5-10(14)7-11(6-9)15-12(17)8-16-3-1-2-4-16/h1-7H,8H2,(H,15,17).
What are the key properties of N-(3,5-dichlorophenyl)-2-pyrrol-1-ylacetamide?
N-(3,5-dichlorophenyl)-2-pyrrol-1-ylacetamide has a molecular weight of 269.13 g/mol, XLogP of 3.43, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dichlorophenyl)-2-pyrrol-1-ylacetamide is sourced from PubChem (CID 110688645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).