N-cyclopentyl-2-[(3,4-dichlorophenyl)methylsulfanyl]acetamide

C14H17Cl2NOS — CID 17309803

IUPACN-cyclopentyl-2-[(3,4-dichlorophenyl)methylsulfanyl]acetamide
SMILESO=C(CSCc1ccc(Cl)c(Cl)c1)NC1CCCC1
InChIInChI=1S/C14H17Cl2NOS/c15-12-6-5-10(7-13(12)16)8-19-9-14(18)17-11-3-1-2-4-11/h5-7,11H,1-4,8-9H2,(H,17,18)
InChIKeyKAXRXTFSZGIWCM-UHFFFAOYSA-N
MW318.27 g/mol
LogP4.29
Rot. Bonds5

About N-cyclopentyl-2-[(3,4-dichlorophenyl)methylsulfanyl]acetamide

N-cyclopentyl-2-[(3,4-dichlorophenyl)methylsulfanyl]acetamide (PubChem CID 17309803) has the molecular formula C14H17Cl2NOS and a molecular weight of 318.27 g/mol. Its IUPAC name is N-cyclopentyl-2-[(3,4-dichlorophenyl)methylsulfanyl]acetamide.

Molecular Properties

Compound NameN-cyclopentyl-2-[(3,4-dichlorophenyl)methylsulfanyl]acetamide
PubChem CID17309803
Molecular FormulaC14H17Cl2NOS
Molecular Weight318.27 g/mol
Exact Mass317.04
IUPAC NameN-cyclopentyl-2-[(3,4-dichlorophenyl)methylsulfanyl]acetamide
SMILESO=C(CSCc1ccc(Cl)c(Cl)c1)NC1CCCC1
InChIInChI=1S/C14H17Cl2NOS/c15-12-6-5-10(7-13(12)16)8-19-9-14(18)17-11-3-1-2-4-11/h5-7,11H,1-4,8-9H2,(H,17,18)
InChIKeyKAXRXTFSZGIWCM-UHFFFAOYSA-N
XLogP4.29
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.27
LogP ≤ 54.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-cyclopentyl-2-[(3,4-dichlorophenyl)methylsulfanyl]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

N-cyclohexyl-2-(3,4-dichlorophenyl)acetamide
CID 2557208
2-(1,3-benzodioxol-5-ylmethylsulfanyl)-N-cyclohexylacetamide
CID 17405781
N-cyclopropyl-2-(3,4-dichlorophenyl)acetamide
CID 2682748
N-[4-(cyclohexylsulfamoyl)phenyl]-2-[(3,4-dichlorophenyl)methylsulfanyl]acetamide
CID 17310008
N-cyclopentyl-2-[(4-methoxyphenyl)methylsulfanyl]acetamide
CID 53279549
2-[(2-chloro-6-fluorophenyl)methylsulfanyl]-N-cyclohexylacetamide
CID 967744
2-[(3-amino-4-hydroxyphenyl)methylsulfanyl]-N-cyclopropylacetamide
CID 114233465
2-[(4-chlorophenyl)methylsulfanyl]-N-piperidin-4-ylacetamide
CID 119388300
(2S)-N-cyclohexyl-2-[[2-[(3,4-dichlorophenyl)methylsulfanyl]acetyl]-[(4-methoxyphenyl)methyl]amino]propanamide
CID 100516189
2-[(4-chlorophenyl)methyl-[2-[(3,4-dichlorophenyl)methylsulfanyl]acetyl]amino]-N-cyclopentyl-3-phenylpropanamide
CID 133248488
2-[[2-[(3,4-dichlorophenyl)methylsulfanyl]acetyl]amino]-N-propan-2-ylacetamide
CID 9301227
(2R)-N-cyclohexyl-2-[[2-[(3,4-dichlorophenyl)methylsulfanyl]acetyl]-[(2-fluorophenyl)methyl]amino]propanamide
CID 100559239

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-[(3,4-dichlorophenyl)methylsulfanyl]acetamide?
The IUPAC name of N-cyclopentyl-2-[(3,4-dichlorophenyl)methylsulfanyl]acetamide (CID 17309803) is N-cyclopentyl-2-[(3,4-dichlorophenyl)methylsulfanyl]acetamide.
What is the SMILES notation for N-cyclopentyl-2-[(3,4-dichlorophenyl)methylsulfanyl]acetamide?
The canonical SMILES for N-cyclopentyl-2-[(3,4-dichlorophenyl)methylsulfanyl]acetamide is O=C(CSCc1ccc(Cl)c(Cl)c1)NC1CCCC1.
What is the InChIKey of N-cyclopentyl-2-[(3,4-dichlorophenyl)methylsulfanyl]acetamide?
The InChIKey is KAXRXTFSZGIWCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17Cl2NOS/c15-12-6-5-10(7-13(12)16)8-19-9-14(18)17-11-3-1-2-4-11/h5-7,11H,1-4,8-9H2,(H,17,18).
What are the key properties of N-cyclopentyl-2-[(3,4-dichlorophenyl)methylsulfanyl]acetamide?
N-cyclopentyl-2-[(3,4-dichlorophenyl)methylsulfanyl]acetamide has a molecular weight of 318.27 g/mol, XLogP of 4.29, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-[(3,4-dichlorophenyl)methylsulfanyl]acetamide is sourced from PubChem (CID 17309803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).