N-(1-cyano-2-methylcyclopentyl)-2-(3,5-dichlorophenyl)-2-hydroxyacetamide

C15H16Cl2N2O2 — CID 110028390

IUPACN-(1-cyano-2-methylcyclopentyl)-2-(3,5-dichlorophenyl)-2-hydroxyacetamide
SMILESCC1CCCC1(C#N)NC(=O)C(O)c1cc(Cl)cc(Cl)c1
InChIInChI=1S/C15H16Cl2N2O2/c1-9-3-2-4-15(9,8-18)19-14(21)13(20)10-5-11(16)7-12(17)6-10/h5-7,9,13,20H,2-4H2,1H3,(H,19,21)
InChIKeyCMEZDRZLUKZFBS-UHFFFAOYSA-N
MW327.21 g/mol
LogP3.23
Rot. Bonds3

About N-(1-cyano-2-methylcyclopentyl)-2-(3,5-dichlorophenyl)-2-hydroxyacetamide

N-(1-cyano-2-methylcyclopentyl)-2-(3,5-dichlorophenyl)-2-hydroxyacetamide (PubChem CID 110028390) has the molecular formula C15H16Cl2N2O2 and a molecular weight of 327.21 g/mol. Its IUPAC name is N-(1-cyano-2-methylcyclopentyl)-2-(3,5-dichlorophenyl)-2-hydroxyacetamide.

Molecular Properties

Compound NameN-(1-cyano-2-methylcyclopentyl)-2-(3,5-dichlorophenyl)-2-hydroxyacetamide
PubChem CID110028390
Molecular FormulaC15H16Cl2N2O2
Molecular Weight327.21 g/mol
Exact Mass326.06
IUPAC NameN-(1-cyano-2-methylcyclopentyl)-2-(3,5-dichlorophenyl)-2-hydroxyacetamide
SMILESCC1CCCC1(C#N)NC(=O)C(O)c1cc(Cl)cc(Cl)c1
InChIInChI=1S/C15H16Cl2N2O2/c1-9-3-2-4-15(9,8-18)19-14(21)13(20)10-5-11(16)7-12(17)6-10/h5-7,9,13,20H,2-4H2,1H3,(H,19,21)
InChIKeyCMEZDRZLUKZFBS-UHFFFAOYSA-N
XLogP3.23
TPSA73.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.21
LogP ≤ 53.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1-cyano-2-methylcyclopentyl)-2-(3,5-dichlorophenyl)-2-hydroxyacetamide?
The IUPAC name of N-(1-cyano-2-methylcyclopentyl)-2-(3,5-dichlorophenyl)-2-hydroxyacetamide (CID 110028390) is N-(1-cyano-2-methylcyclopentyl)-2-(3,5-dichlorophenyl)-2-hydroxyacetamide.
What is the SMILES notation for N-(1-cyano-2-methylcyclopentyl)-2-(3,5-dichlorophenyl)-2-hydroxyacetamide?
The canonical SMILES for N-(1-cyano-2-methylcyclopentyl)-2-(3,5-dichlorophenyl)-2-hydroxyacetamide is CC1CCCC1(C#N)NC(=O)C(O)c1cc(Cl)cc(Cl)c1.
What is the InChIKey of N-(1-cyano-2-methylcyclopentyl)-2-(3,5-dichlorophenyl)-2-hydroxyacetamide?
The InChIKey is CMEZDRZLUKZFBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16Cl2N2O2/c1-9-3-2-4-15(9,8-18)19-14(21)13(20)10-5-11(16)7-12(17)6-10/h5-7,9,13,20H,2-4H2,1H3,(H,19,21).
What are the key properties of N-(1-cyano-2-methylcyclopentyl)-2-(3,5-dichlorophenyl)-2-hydroxyacetamide?
N-(1-cyano-2-methylcyclopentyl)-2-(3,5-dichlorophenyl)-2-hydroxyacetamide has a molecular weight of 327.21 g/mol, XLogP of 3.23, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyano-2-methylcyclopentyl)-2-(3,5-dichlorophenyl)-2-hydroxyacetamide is sourced from PubChem (CID 110028390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).