3-methoxy-N-[(Z)-3-methylsulfanylpent-3-enyl]benzamide

C14H19NO2S — CID 143043134

IUPAC3-methoxy-N-[(Z)-3-methylsulfanylpent-3-enyl]benzamide
SMILESC/C=C(/CCNC(=O)c1cccc(OC)c1)SC
InChIInChI=1S/C14H19NO2S/c1-4-13(18-3)8-9-15-14(16)11-6-5-7-12(10-11)17-2/h4-7,10H,8-9H2,1-3H3,(H,15,16)/b13-4-
InChIKeyWXSFGICXGZWFKW-PQMHYQBVSA-N
MW265.38 g/mol
LogP3.08
Rot. Bonds6

About 3-methoxy-N-[(Z)-3-methylsulfanylpent-3-enyl]benzamide

3-methoxy-N-[(Z)-3-methylsulfanylpent-3-enyl]benzamide (PubChem CID 143043134) has the molecular formula C14H19NO2S and a molecular weight of 265.38 g/mol. Its IUPAC name is 3-methoxy-N-[(Z)-3-methylsulfanylpent-3-enyl]benzamide.

Molecular Properties

Compound Name3-methoxy-N-[(Z)-3-methylsulfanylpent-3-enyl]benzamide
PubChem CID143043134
Molecular FormulaC14H19NO2S
Molecular Weight265.38 g/mol
Exact Mass265.11
IUPAC Name3-methoxy-N-[(Z)-3-methylsulfanylpent-3-enyl]benzamide
SMILESC/C=C(/CCNC(=O)c1cccc(OC)c1)SC
InChIInChI=1S/C14H19NO2S/c1-4-13(18-3)8-9-15-14(16)11-6-5-7-12(10-11)17-2/h4-7,10H,8-9H2,1-3H3,(H,15,16)/b13-4-
InChIKeyWXSFGICXGZWFKW-PQMHYQBVSA-N
XLogP3.08
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.38
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-methoxy-N-[(Z)-3-methylsulfanylpent-3-enyl]benzamide 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

3-methoxy-N-[3-[(3-methoxybenzoyl)amino]propyl]benzamide
CID 2167030
N-[2-[(3-methoxybenzoyl)amino]ethyl]-3,4-dimethylbenzamide
CID 108539237
N-[3-(4-fluoroanilino)-3-oxopropyl]-3-methoxybenzamide
CID 17226080
3-methoxy-N-[3-oxo-3-(pyridin-4-ylamino)propyl]benzamide
CID 17226091
N-(2-tert-butylsulfanylethyl)-3-methoxybenzamide
CID 71879808
N-(6-bromohexyl)-3-methoxybenzamide
CID 114008510
3-methoxy-N-tridecylbenzamide
CID 139819898
3-[2-[(3-methoxybenzoyl)amino]ethoxy]propanoic acid
CID 112739190
3-methoxy-N-[2-[(2-phenylacetyl)amino]ethyl]benzamide
CID 40718391
N-[3-(dimethylamino)propyl]-3-methoxybenzamide
CID 3117661
N-[2-(methanesulfonamido)ethyl]-3-methoxybenzamide
CID 40718415
3-methoxy-N-[2-[(4-phenylbenzoyl)amino]ethyl]benzamide
CID 40718395

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-N-[(Z)-3-methylsulfanylpent-3-enyl]benzamide?
The IUPAC name of 3-methoxy-N-[(Z)-3-methylsulfanylpent-3-enyl]benzamide (CID 143043134) is 3-methoxy-N-[(Z)-3-methylsulfanylpent-3-enyl]benzamide.
What is the SMILES notation for 3-methoxy-N-[(Z)-3-methylsulfanylpent-3-enyl]benzamide?
The canonical SMILES for 3-methoxy-N-[(Z)-3-methylsulfanylpent-3-enyl]benzamide is C/C=C(/CCNC(=O)c1cccc(OC)c1)SC.
What is the InChIKey of 3-methoxy-N-[(Z)-3-methylsulfanylpent-3-enyl]benzamide?
The InChIKey is WXSFGICXGZWFKW-PQMHYQBVSA-N. The full InChI is InChI=1S/C14H19NO2S/c1-4-13(18-3)8-9-15-14(16)11-6-5-7-12(10-11)17-2/h4-7,10H,8-9H2,1-3H3,(H,15,16)/b13-4-.
What are the key properties of 3-methoxy-N-[(Z)-3-methylsulfanylpent-3-enyl]benzamide?
3-methoxy-N-[(Z)-3-methylsulfanylpent-3-enyl]benzamide has a molecular weight of 265.38 g/mol, XLogP of 3.08, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-N-[(Z)-3-methylsulfanylpent-3-enyl]benzamide is sourced from PubChem (CID 143043134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).