2,6-dichloro-N-(3-chloropropyl)benzamide

C10H10Cl3NO — CID 3367173

IUPAC2,6-dichloro-N-(3-chloropropyl)benzamide
SMILESO=C(NCCCCl)c1c(Cl)cccc1Cl
InChIInChI=1S/C10H10Cl3NO/c11-5-2-6-14-10(15)9-7(12)3-1-4-8(9)13/h1,3-4H,2,5-6H2,(H,14,15)
InChIKeyPBHMEUGFGUOZRY-UHFFFAOYSA-N
MW266.55 g/mol
LogP3.35
Rot. Bonds4

About 2,6-dichloro-N-(3-chloropropyl)benzamide

2,6-dichloro-N-(3-chloropropyl)benzamide (PubChem CID 3367173) has the molecular formula C10H10Cl3NO and a molecular weight of 266.55 g/mol. Its IUPAC name is 2,6-dichloro-N-(3-chloropropyl)benzamide.

Molecular Properties

Compound Name2,6-dichloro-N-(3-chloropropyl)benzamide
PubChem CID3367173
Molecular FormulaC10H10Cl3NO
Molecular Weight266.55 g/mol
Exact Mass264.98
IUPAC Name2,6-dichloro-N-(3-chloropropyl)benzamide
SMILESO=C(NCCCCl)c1c(Cl)cccc1Cl
InChIInChI=1S/C10H10Cl3NO/c11-5-2-6-14-10(15)9-7(12)3-1-4-8(9)13/h1,3-4H,2,5-6H2,(H,14,15)
InChIKeyPBHMEUGFGUOZRY-UHFFFAOYSA-N
XLogP3.35
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.55
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-(3-bromopropyl)-2,6-dichlorobenzamide
CID 43133585
N-(4-amino-4-sulfanylidenebutyl)-2,6-dichlorobenzamide
CID 62666216
N-(3-azidopropyl)-2,6-dichlorobenzamide
CID 61343646
2-chloro-N-(4-chlorobutyl)benzamide
CID 106845467
N-(6-chlorohexyl)-2,6-dimethylbenzamide
CID 114026632
N-(5-bromopentyl)-2-chloro-6-fluorobenzamide
CID 107321928
8-[(2-chloro-6-fluorobenzoyl)amino]octanoic acid
CID 10663193
2,6-dichloro-N-[2-(4-fluorophenyl)ethyl]benzamide
CID 1122033
N-(5-chloropentyl)-2-fluoro-6-hydroxybenzamide
CID 107321513
N-(3-chloropropyl)naphthalene-1-carboxamide
CID 17164120
2,6-dichloro-N-(2-piperazin-1-ylethyl)benzamide
CID 43422024
N-but-2-ynyl-2,6-dichlorobenzamide
CID 143542112

Frequently Asked Questions

What is the IUPAC name of 2,6-dichloro-N-(3-chloropropyl)benzamide?
The IUPAC name of 2,6-dichloro-N-(3-chloropropyl)benzamide (CID 3367173) is 2,6-dichloro-N-(3-chloropropyl)benzamide.
What is the SMILES notation for 2,6-dichloro-N-(3-chloropropyl)benzamide?
The canonical SMILES for 2,6-dichloro-N-(3-chloropropyl)benzamide is O=C(NCCCCl)c1c(Cl)cccc1Cl.
What is the InChIKey of 2,6-dichloro-N-(3-chloropropyl)benzamide?
The InChIKey is PBHMEUGFGUOZRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10Cl3NO/c11-5-2-6-14-10(15)9-7(12)3-1-4-8(9)13/h1,3-4H,2,5-6H2,(H,14,15).
What are the key properties of 2,6-dichloro-N-(3-chloropropyl)benzamide?
2,6-dichloro-N-(3-chloropropyl)benzamide has a molecular weight of 266.55 g/mol, XLogP of 3.35, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dichloro-N-(3-chloropropyl)benzamide is sourced from PubChem (CID 3367173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).