N-(3,5-dichlorophenyl)cyclopentanecarboxamide

C12H13Cl2NO — CID 2166648

IUPACN-(3,5-dichlorophenyl)cyclopentanecarboxamide
SMILESO=C(Nc1cc(Cl)cc(Cl)c1)C1CCCC1
InChIInChI=1S/C12H13Cl2NO/c13-9-5-10(14)7-11(6-9)15-12(16)8-3-1-2-4-8/h5-8H,1-4H2,(H,15,16)
InChIKeySKZCBANSXSXPLM-UHFFFAOYSA-N
MW258.15 g/mol
LogP4.12
Rot. Bonds2

About N-(3,5-dichlorophenyl)cyclopentanecarboxamide

N-(3,5-dichlorophenyl)cyclopentanecarboxamide (PubChem CID 2166648) has the molecular formula C12H13Cl2NO and a molecular weight of 258.15 g/mol. Its IUPAC name is N-(3,5-dichlorophenyl)cyclopentanecarboxamide.

Molecular Properties

Compound NameN-(3,5-dichlorophenyl)cyclopentanecarboxamide
PubChem CID2166648
Molecular FormulaC12H13Cl2NO
Molecular Weight258.15 g/mol
Exact Mass257.04
IUPAC NameN-(3,5-dichlorophenyl)cyclopentanecarboxamide
SMILESO=C(Nc1cc(Cl)cc(Cl)c1)C1CCCC1
InChIInChI=1S/C12H13Cl2NO/c13-9-5-10(14)7-11(6-9)15-12(16)8-3-1-2-4-8/h5-8H,1-4H2,(H,15,16)
InChIKeySKZCBANSXSXPLM-UHFFFAOYSA-N
XLogP4.12
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.15
LogP ≤ 54.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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CID 11493
Monalide
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Pentanochlor
CID 16826
3',4'-Dichlorocyclohexanecarboxanilide
CID 140002
N-(3-chlorophenyl)cyclohexanecarboxamide
CID 531819
Erlujixiancaoan
CID 595317
Acetamide, N-(3,5-dichlorophenyl)-
CID 182054
N-(3-chlorophenyl)pivalamide
CID 532035
N-(3-Chloro-phenyl)-2-cyclohexyl-acetamide
CID 11379743
N-(3-chloro-4-fluorophenyl)cyclopentanecarboxamide
CID 845055
N-(2,6-dichlorophenyl)cyclobutanecarboxamide
CID 660590
N-(4-chlorophenyl)cyclopentanecarboxamide
CID 849228

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dichlorophenyl)cyclopentanecarboxamide?
The IUPAC name of N-(3,5-dichlorophenyl)cyclopentanecarboxamide (CID 2166648) is N-(3,5-dichlorophenyl)cyclopentanecarboxamide.
What is the SMILES notation for N-(3,5-dichlorophenyl)cyclopentanecarboxamide?
The canonical SMILES for N-(3,5-dichlorophenyl)cyclopentanecarboxamide is O=C(Nc1cc(Cl)cc(Cl)c1)C1CCCC1.
What is the InChIKey of N-(3,5-dichlorophenyl)cyclopentanecarboxamide?
The InChIKey is SKZCBANSXSXPLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13Cl2NO/c13-9-5-10(14)7-11(6-9)15-12(16)8-3-1-2-4-8/h5-8H,1-4H2,(H,15,16).
What are the key properties of N-(3,5-dichlorophenyl)cyclopentanecarboxamide?
N-(3,5-dichlorophenyl)cyclopentanecarboxamide has a molecular weight of 258.15 g/mol, XLogP of 4.12, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dichlorophenyl)cyclopentanecarboxamide is sourced from PubChem (CID 2166648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).