N-[4-[(Z)-2-phenylethenyl]sulfanylphenyl]acetamide

C16H15NOS — CID 73053859

IUPACN-[4-[(Z)-2-phenylethenyl]sulfanylphenyl]acetamide
SMILESCC(=O)Nc1ccc(S/C=C\c2ccccc2)cc1
InChIInChI=1S/C16H15NOS/c1-13(18)17-15-7-9-16(10-8-15)19-12-11-14-5-3-2-4-6-14/h2-12H,1H3,(H,17,18)/b12-11-
InChIKeyUTWNLLSZVHVJMH-QXMHVHEDSA-N
MW269.37 g/mol
LogP4.41
Rot. Bonds4

About N-[4-[(Z)-2-phenylethenyl]sulfanylphenyl]acetamide

N-[4-[(Z)-2-phenylethenyl]sulfanylphenyl]acetamide (PubChem CID 73053859) has the molecular formula C16H15NOS and a molecular weight of 269.37 g/mol. Its IUPAC name is N-[4-[(Z)-2-phenylethenyl]sulfanylphenyl]acetamide.

Molecular Properties

Compound NameN-[4-[(Z)-2-phenylethenyl]sulfanylphenyl]acetamide
PubChem CID73053859
Molecular FormulaC16H15NOS
Molecular Weight269.37 g/mol
Exact Mass269.09
IUPAC NameN-[4-[(Z)-2-phenylethenyl]sulfanylphenyl]acetamide
SMILESCC(=O)Nc1ccc(S/C=C\c2ccccc2)cc1
InChIInChI=1S/C16H15NOS/c1-13(18)17-15-7-9-16(10-8-15)19-12-11-14-5-3-2-4-6-14/h2-12H,1H3,(H,17,18)/b12-11-
InChIKeyUTWNLLSZVHVJMH-QXMHVHEDSA-N
XLogP4.41
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.37
LogP ≤ 54.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[4-[(Z)-2-phenylethenyl]sulfanylphenyl]acetamide?
The IUPAC name of N-[4-[(Z)-2-phenylethenyl]sulfanylphenyl]acetamide (CID 73053859) is N-[4-[(Z)-2-phenylethenyl]sulfanylphenyl]acetamide.
What is the SMILES notation for N-[4-[(Z)-2-phenylethenyl]sulfanylphenyl]acetamide?
The canonical SMILES for N-[4-[(Z)-2-phenylethenyl]sulfanylphenyl]acetamide is CC(=O)Nc1ccc(S/C=C\c2ccccc2)cc1.
What is the InChIKey of N-[4-[(Z)-2-phenylethenyl]sulfanylphenyl]acetamide?
The InChIKey is UTWNLLSZVHVJMH-QXMHVHEDSA-N. The full InChI is InChI=1S/C16H15NOS/c1-13(18)17-15-7-9-16(10-8-15)19-12-11-14-5-3-2-4-6-14/h2-12H,1H3,(H,17,18)/b12-11-.
What are the key properties of N-[4-[(Z)-2-phenylethenyl]sulfanylphenyl]acetamide?
N-[4-[(Z)-2-phenylethenyl]sulfanylphenyl]acetamide has a molecular weight of 269.37 g/mol, XLogP of 4.41, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(Z)-2-phenylethenyl]sulfanylphenyl]acetamide is sourced from PubChem (CID 73053859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).