2-(5-chloro-2-methoxyphenyl)-N-(1-cyanocyclopentyl)acetamide

C15H17ClN2O2 — CID 86913686

IUPAC2-(5-chloro-2-methoxyphenyl)-N-(1-cyanocyclopentyl)acetamide
SMILESCOc1ccc(Cl)cc1CC(=O)NC1(C#N)CCCC1
InChIInChI=1S/C15H17ClN2O2/c1-20-13-5-4-12(16)8-11(13)9-14(19)18-15(10-17)6-2-3-7-15/h4-5,8H,2-3,6-7,9H2,1H3,(H,18,19)
InChIKeyIIKLNIIDNNTAED-UHFFFAOYSA-N
MW292.77 g/mol
LogP2.84
Rot. Bonds4

About 2-(5-chloro-2-methoxyphenyl)-N-(1-cyanocyclopentyl)acetamide

2-(5-chloro-2-methoxyphenyl)-N-(1-cyanocyclopentyl)acetamide (PubChem CID 86913686) has the molecular formula C15H17ClN2O2 and a molecular weight of 292.77 g/mol. Its IUPAC name is 2-(5-chloro-2-methoxyphenyl)-N-(1-cyanocyclopentyl)acetamide.

Molecular Properties

Compound Name2-(5-chloro-2-methoxyphenyl)-N-(1-cyanocyclopentyl)acetamide
PubChem CID86913686
Molecular FormulaC15H17ClN2O2
Molecular Weight292.77 g/mol
Exact Mass292.10
IUPAC Name2-(5-chloro-2-methoxyphenyl)-N-(1-cyanocyclopentyl)acetamide
SMILESCOc1ccc(Cl)cc1CC(=O)NC1(C#N)CCCC1
InChIInChI=1S/C15H17ClN2O2/c1-20-13-5-4-12(16)8-11(13)9-14(19)18-15(10-17)6-2-3-7-15/h4-5,8H,2-3,6-7,9H2,1H3,(H,18,19)
InChIKeyIIKLNIIDNNTAED-UHFFFAOYSA-N
XLogP2.84
TPSA62.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.77
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(5-chloro-2-methoxyphenyl)-N-(1-cyanocyclopentyl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[(5-chloro-2-methoxyphenyl)methyl-methylamino]-N-(1-cyanocyclopentyl)acetamide
CID 9136887
2-(4-chlorophenyl)-N-(1-cyanocyclopentyl)acetamide
CID 60659352
N-(1-cyanocyclohexyl)-2-(3,4,5-trimethoxyphenyl)acetamide
CID 60592214
2-[[5-(5-chloro-2-methoxyphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(1-cyanocyclopentyl)acetamide
CID 7982497
N-(4-cyanothian-4-yl)-2-(2-methoxyphenyl)acetamide
CID 75389910
N-(1-cyanocyclopentyl)-2-(3,4-dimethylphenyl)acetamide
CID 55023977
2-(5-chloro-2-methoxyphenyl)-1-[1-(dimethylamino)cyclopentyl]ethanone
CID 79067216
N-(1-cyanocycloheptyl)-4-fluoro-3-methoxybenzamide
CID 81041266
[2-[(1-cyanocyclopentyl)amino]-2-oxoethyl] 5-chloro-2-fluorobenzoate
CID 8620571
1-[[(5-chloro-2-methoxyphenyl)methylamino]methyl]cyclopropane-1-carbonitrile
CID 115242214
3-(4-chlorophenyl)-N-(1-cyanocyclopentyl)propanamide
CID 78830459
2-(5-chloro-2-methoxyphenyl)-N-cyclopentyloxyacetamide
CID 83202101

Frequently Asked Questions

What is the IUPAC name of 2-(5-chloro-2-methoxyphenyl)-N-(1-cyanocyclopentyl)acetamide?
The IUPAC name of 2-(5-chloro-2-methoxyphenyl)-N-(1-cyanocyclopentyl)acetamide (CID 86913686) is 2-(5-chloro-2-methoxyphenyl)-N-(1-cyanocyclopentyl)acetamide.
What is the SMILES notation for 2-(5-chloro-2-methoxyphenyl)-N-(1-cyanocyclopentyl)acetamide?
The canonical SMILES for 2-(5-chloro-2-methoxyphenyl)-N-(1-cyanocyclopentyl)acetamide is COc1ccc(Cl)cc1CC(=O)NC1(C#N)CCCC1.
What is the InChIKey of 2-(5-chloro-2-methoxyphenyl)-N-(1-cyanocyclopentyl)acetamide?
The InChIKey is IIKLNIIDNNTAED-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17ClN2O2/c1-20-13-5-4-12(16)8-11(13)9-14(19)18-15(10-17)6-2-3-7-15/h4-5,8H,2-3,6-7,9H2,1H3,(H,18,19).
What are the key properties of 2-(5-chloro-2-methoxyphenyl)-N-(1-cyanocyclopentyl)acetamide?
2-(5-chloro-2-methoxyphenyl)-N-(1-cyanocyclopentyl)acetamide has a molecular weight of 292.77 g/mol, XLogP of 2.84, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-chloro-2-methoxyphenyl)-N-(1-cyanocyclopentyl)acetamide is sourced from PubChem (CID 86913686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).