2,5-dichloro-N-(2-cyanocyclopentyl)benzamide

C13H12Cl2N2O — CID 55152720

IUPAC2,5-dichloro-N-(2-cyanocyclopentyl)benzamide
SMILESN#CC1CCCC1NC(=O)c1cc(Cl)ccc1Cl
InChIInChI=1S/C13H12Cl2N2O/c14-9-4-5-11(15)10(6-9)13(18)17-12-3-1-2-8(12)7-16/h4-6,8,12H,1-3H2,(H,17,18)
InChIKeyNWQNEDBGMMBFKQ-UHFFFAOYSA-N
MW283.16 g/mol
LogP3.42
Rot. Bonds2

About 2,5-dichloro-N-(2-cyanocyclopentyl)benzamide

2,5-dichloro-N-(2-cyanocyclopentyl)benzamide (PubChem CID 55152720) has the molecular formula C13H12Cl2N2O and a molecular weight of 283.16 g/mol. Its IUPAC name is 2,5-dichloro-N-(2-cyanocyclopentyl)benzamide.

Molecular Properties

Compound Name2,5-dichloro-N-(2-cyanocyclopentyl)benzamide
PubChem CID55152720
Molecular FormulaC13H12Cl2N2O
Molecular Weight283.16 g/mol
Exact Mass282.03
IUPAC Name2,5-dichloro-N-(2-cyanocyclopentyl)benzamide
SMILESN#CC1CCCC1NC(=O)c1cc(Cl)ccc1Cl
InChIInChI=1S/C13H12Cl2N2O/c14-9-4-5-11(15)10(6-9)13(18)17-12-3-1-2-8(12)7-16/h4-6,8,12H,1-3H2,(H,17,18)
InChIKeyNWQNEDBGMMBFKQ-UHFFFAOYSA-N
XLogP3.42
TPSA52.89 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.16
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-chloro-N-(2-cyanocyclopentyl)-2-hydroxybenzamide
CID 62961255
4-chloro-N-(2-cyanocyclopentyl)-3-fluorobenzamide
CID 103876619
3,5-dichloro-N-(2-cyanocyclopentyl)benzamide
CID 62961800
2,5-dichloro-N-(2,3-dimethylcyclohexyl)benzamide
CID 43007916
2,6-dichloro-N-(2-cyanocyclopentyl)pyridine-3-carboxamide
CID 106993787
3-chloro-N-(2-cyanocyclopentyl)-5-methylbenzamide
CID 81002663
2,5-dichloro-N-[2-(N'-hydroxycarbamimidoyl)cyclopentyl]benzamide
CID 76978437
2,5-dichloro-N-[4-[(2,5-dichlorobenzoyl)amino]cyclohexyl]benzamide
CID 2165949
N-(2-cyanocyclopentyl)-2-ethylfuran-3-carboxamide
CID 114103038
6-chloro-N-(2-cyanocyclopentyl)pyridine-2-carboxamide
CID 62961274
3,5-dibromo-N-(2-cyanocyclopentyl)benzamide
CID 103908948
5-chloro-N-(2-cyanocyclopentyl)-1,3,4-thiadiazole-2-carboxamide
CID 80619442

Frequently Asked Questions

What is the IUPAC name of 2,5-dichloro-N-(2-cyanocyclopentyl)benzamide?
The IUPAC name of 2,5-dichloro-N-(2-cyanocyclopentyl)benzamide (CID 55152720) is 2,5-dichloro-N-(2-cyanocyclopentyl)benzamide.
What is the SMILES notation for 2,5-dichloro-N-(2-cyanocyclopentyl)benzamide?
The canonical SMILES for 2,5-dichloro-N-(2-cyanocyclopentyl)benzamide is N#CC1CCCC1NC(=O)c1cc(Cl)ccc1Cl.
What is the InChIKey of 2,5-dichloro-N-(2-cyanocyclopentyl)benzamide?
The InChIKey is NWQNEDBGMMBFKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12Cl2N2O/c14-9-4-5-11(15)10(6-9)13(18)17-12-3-1-2-8(12)7-16/h4-6,8,12H,1-3H2,(H,17,18).
What are the key properties of 2,5-dichloro-N-(2-cyanocyclopentyl)benzamide?
2,5-dichloro-N-(2-cyanocyclopentyl)benzamide has a molecular weight of 283.16 g/mol, XLogP of 3.42, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dichloro-N-(2-cyanocyclopentyl)benzamide is sourced from PubChem (CID 55152720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).