2,5-dichloro-N-[2-(2-hydroxyethyl)pentyl]benzamide

C14H19Cl2NO2 — CID 103725481

IUPAC2,5-dichloro-N-[2-(2-hydroxyethyl)pentyl]benzamide
SMILESCCCC(CCO)CNC(=O)c1cc(Cl)ccc1Cl
InChIInChI=1S/C14H19Cl2NO2/c1-2-3-10(6-7-18)9-17-14(19)12-8-11(15)4-5-13(12)16/h4-5,8,10,18H,2-3,6-7,9H2,1H3,(H,17,19)
InChIKeyUQPSKODPILLQOI-UHFFFAOYSA-N
MW304.22 g/mol
LogP3.52
Rot. Bonds7

About 2,5-dichloro-N-[2-(2-hydroxyethyl)pentyl]benzamide

2,5-dichloro-N-[2-(2-hydroxyethyl)pentyl]benzamide (PubChem CID 103725481) has the molecular formula C14H19Cl2NO2 and a molecular weight of 304.22 g/mol. Its IUPAC name is 2,5-dichloro-N-[2-(2-hydroxyethyl)pentyl]benzamide.

Molecular Properties

Compound Name2,5-dichloro-N-[2-(2-hydroxyethyl)pentyl]benzamide
PubChem CID103725481
Molecular FormulaC14H19Cl2NO2
Molecular Weight304.22 g/mol
Exact Mass303.08
IUPAC Name2,5-dichloro-N-[2-(2-hydroxyethyl)pentyl]benzamide
SMILESCCCC(CCO)CNC(=O)c1cc(Cl)ccc1Cl
InChIInChI=1S/C14H19Cl2NO2/c1-2-3-10(6-7-18)9-17-14(19)12-8-11(15)4-5-13(12)16/h4-5,8,10,18H,2-3,6-7,9H2,1H3,(H,17,19)
InChIKeyUQPSKODPILLQOI-UHFFFAOYSA-N
XLogP3.52
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.22
LogP ≤ 53.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

5-chloro-N-[2-(2-hydroxyethyl)pentyl]-2-methoxybenzamide
CID 103722628
4-chloro-N-[2-(2-hydroxyethyl)pentyl]-2-methoxybenzamide
CID 103722901
2-chloro-N-[2-(2-hydroxyethyl)pentyl]benzamide
CID 103722702
2-chloro-N-[2-(2-hydroxyethyl)pentyl]-4-methylbenzamide
CID 106509848
5-chloro-N-(2-ethyl-4-hydroxybutyl)-2-iodobenzamide
CID 113254459
N-[2-(2-hydroxyethyl)pentyl]-2,5-dimethylbenzamide
CID 103725617
5-bromo-N-[2-(2-hydroxyethyl)pentyl]-2-methylbenzamide
CID 103725574
N-[2-(2-hydroxyethyl)pentyl]-2,4-dimethylbenzamide
CID 103722758
2,5-dichloro-N-[(2R)-2-hydroxypropyl]benzamide
CID 83031874
1-(4-chlorophenyl)-3-[2-(2-hydroxyethyl)pentyl]urea
CID 103709965
5-chloro-N-(2-ethylhexyl)-2-hydroxybenzamide
CID 14692803
2-hydroxy-N-[2-(2-hydroxyethyl)pentyl]-3,4-dimethylbenzamide
CID 111697393

Frequently Asked Questions

What is the IUPAC name of 2,5-dichloro-N-[2-(2-hydroxyethyl)pentyl]benzamide?
The IUPAC name of 2,5-dichloro-N-[2-(2-hydroxyethyl)pentyl]benzamide (CID 103725481) is 2,5-dichloro-N-[2-(2-hydroxyethyl)pentyl]benzamide.
What is the SMILES notation for 2,5-dichloro-N-[2-(2-hydroxyethyl)pentyl]benzamide?
The canonical SMILES for 2,5-dichloro-N-[2-(2-hydroxyethyl)pentyl]benzamide is CCCC(CCO)CNC(=O)c1cc(Cl)ccc1Cl.
What is the InChIKey of 2,5-dichloro-N-[2-(2-hydroxyethyl)pentyl]benzamide?
The InChIKey is UQPSKODPILLQOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19Cl2NO2/c1-2-3-10(6-7-18)9-17-14(19)12-8-11(15)4-5-13(12)16/h4-5,8,10,18H,2-3,6-7,9H2,1H3,(H,17,19).
What are the key properties of 2,5-dichloro-N-[2-(2-hydroxyethyl)pentyl]benzamide?
2,5-dichloro-N-[2-(2-hydroxyethyl)pentyl]benzamide has a molecular weight of 304.22 g/mol, XLogP of 3.52, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dichloro-N-[2-(2-hydroxyethyl)pentyl]benzamide is sourced from PubChem (CID 103725481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).