N-[(2-cyclopentyloxy-3-pyridinyl)methyl]-2-phenylsulfanylpropanamide

C20H24N2O2S — CID 46434537

IUPACN-[(2-cyclopentyloxy-3-pyridinyl)methyl]-2-phenylsulfanylpropanamide
SMILESCC(Sc1ccccc1)C(=O)NCc1cccnc1OC1CCCC1
InChIInChI=1S/C20H24N2O2S/c1-15(25-18-11-3-2-4-12-18)19(23)22-14-16-8-7-13-21-20(16)24-17-9-5-6-10-17/h2-4,7-8,11-13,15,17H,5-6,9-10,14H2,1H3,(H,22,23)
InChIKeyPRINMYJNLGRSTC-UHFFFAOYSA-N
MW356.49 g/mol
LogP4.20
Rot. Bonds7

About N-[(2-cyclopentyloxy-3-pyridinyl)methyl]-2-phenylsulfanylpropanamide

N-[(2-cyclopentyloxy-3-pyridinyl)methyl]-2-phenylsulfanylpropanamide (PubChem CID 46434537) has the molecular formula C20H24N2O2S and a molecular weight of 356.49 g/mol. Its IUPAC name is N-[(2-cyclopentyloxy-3-pyridinyl)methyl]-2-phenylsulfanylpropanamide.

Molecular Properties

Compound NameN-[(2-cyclopentyloxy-3-pyridinyl)methyl]-2-phenylsulfanylpropanamide
PubChem CID46434537
Molecular FormulaC20H24N2O2S
Molecular Weight356.49 g/mol
Exact Mass356.16
IUPAC NameN-[(2-cyclopentyloxy-3-pyridinyl)methyl]-2-phenylsulfanylpropanamide
SMILESCC(Sc1ccccc1)C(=O)NCc1cccnc1OC1CCCC1
InChIInChI=1S/C20H24N2O2S/c1-15(25-18-11-3-2-4-12-18)19(23)22-14-16-8-7-13-21-20(16)24-17-9-5-6-10-17/h2-4,7-8,11-13,15,17H,5-6,9-10,14H2,1H3,(H,22,23)
InChIKeyPRINMYJNLGRSTC-UHFFFAOYSA-N
XLogP4.20
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.49
LogP ≤ 54.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[(2-cyclopentyloxy-3-pyridinyl)methyl]-2-phenylsulfanylpropanamide 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-phenylsulfanyl-N-[[2-(2,2,2-trifluoroethoxy)-3-pyridinyl]methyl]propanamide
CID 55613812
(2R)-2-[(3aR,7aR)-1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl]-N-[(2-cyclopentyloxy-3-pyridinyl)methyl]propanamide
CID 124742659
(2R)-N-[(2-cyclopentyloxy-3-pyridinyl)methyl]-2-(1,3-dioxoisoindol-2-yl)-3-methylbutanamide
CID 51942830
N-[(2-cyclobutyloxy-3-pyridinyl)methyl]propan-2-amine
CID 62287341
2-[4-(2-cyclopentyloxy-3-pyridinyl)phenyl]sulfanylpropanoic acid
CID 141426986
(2S)-2-phenylsulfanyl-N-(pyridin-2-ylmethyl)propanamide
CID 28771750
N-[(2-cyclopentyloxy-3-pyridinyl)methyl]-2,3-dimethylbenzamide
CID 47029217
2-[1-(1H-benzimidazol-2-yl)ethylsulfanyl]-N-[(2-cyclopentyloxy-3-pyridinyl)methyl]acetamide
CID 78864061
N-[(2-cyclopentyloxy-3-pyridinyl)methyl]-4-methyl-6-methylsulfanyl-2-propan-2-ylpyrimidine-5-carboxamide
CID 78864064
N-[2-[(2-cyclopentyloxy-3-pyridinyl)methylamino]-2-oxoethyl]-3,5-dimethylbenzamide
CID 55659721
1-[(2-cyclopentyloxy-3-pyridinyl)methyl]-3-[(2S)-2-(2,3-dihydroindol-1-yl)propyl]urea
CID 38314037
N-[(2-cyclopentyloxy-3-pyridinyl)methyl]-2-(1-phenylpyrazol-4-yl)acetamide
CID 47029191

Frequently Asked Questions

What is the IUPAC name of N-[(2-cyclopentyloxy-3-pyridinyl)methyl]-2-phenylsulfanylpropanamide?
The IUPAC name of N-[(2-cyclopentyloxy-3-pyridinyl)methyl]-2-phenylsulfanylpropanamide (CID 46434537) is N-[(2-cyclopentyloxy-3-pyridinyl)methyl]-2-phenylsulfanylpropanamide.
What is the SMILES notation for N-[(2-cyclopentyloxy-3-pyridinyl)methyl]-2-phenylsulfanylpropanamide?
The canonical SMILES for N-[(2-cyclopentyloxy-3-pyridinyl)methyl]-2-phenylsulfanylpropanamide is CC(Sc1ccccc1)C(=O)NCc1cccnc1OC1CCCC1.
What is the InChIKey of N-[(2-cyclopentyloxy-3-pyridinyl)methyl]-2-phenylsulfanylpropanamide?
The InChIKey is PRINMYJNLGRSTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O2S/c1-15(25-18-11-3-2-4-12-18)19(23)22-14-16-8-7-13-21-20(16)24-17-9-5-6-10-17/h2-4,7-8,11-13,15,17H,5-6,9-10,14H2,1H3,(H,22,23).
What are the key properties of N-[(2-cyclopentyloxy-3-pyridinyl)methyl]-2-phenylsulfanylpropanamide?
N-[(2-cyclopentyloxy-3-pyridinyl)methyl]-2-phenylsulfanylpropanamide has a molecular weight of 356.49 g/mol, XLogP of 4.20, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-cyclopentyloxy-3-pyridinyl)methyl]-2-phenylsulfanylpropanamide is sourced from PubChem (CID 46434537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).