3-(2-methoxyphenyl)-N-methylprop-2-ynamide

C11H11NO2 — CID 154718529

IUPAC3-(2-methoxyphenyl)-N-methylprop-2-ynamide
SMILESCNC(=O)C#Cc1ccccc1OC
InChIInChI=1S/C11H11NO2/c1-12-11(13)8-7-9-5-3-4-6-10(9)14-2/h3-6H,1-2H3,(H,12,13)
InChIKeySAEXBMFLFKILTQ-UHFFFAOYSA-N
MW189.21 g/mol
LogP0.79
Rot. Bonds1

About 3-(2-methoxyphenyl)-N-methylprop-2-ynamide

3-(2-methoxyphenyl)-N-methylprop-2-ynamide (PubChem CID 154718529) has the molecular formula C11H11NO2 and a molecular weight of 189.21 g/mol. Its IUPAC name is 3-(2-methoxyphenyl)-N-methylprop-2-ynamide.

Molecular Properties

Compound Name3-(2-methoxyphenyl)-N-methylprop-2-ynamide
PubChem CID154718529
Molecular FormulaC11H11NO2
Molecular Weight189.21 g/mol
Exact Mass189.08
IUPAC Name3-(2-methoxyphenyl)-N-methylprop-2-ynamide
SMILESCNC(=O)C#Cc1ccccc1OC
InChIInChI=1S/C11H11NO2/c1-12-11(13)8-7-9-5-3-4-6-10(9)14-2/h3-6H,1-2H3,(H,12,13)
InChIKeySAEXBMFLFKILTQ-UHFFFAOYSA-N
XLogP0.79
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.21
LogP ≤ 50.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'triple_bond', 'substructure': 'N/A'}

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Related Compounds

1,2-bis[2-(2-methoxyphenyl)ethynyl]benzene
CID 11313747
2-[2-(2-methoxyphenyl)ethynyl]benzaldehyde
CID 25215814
1-[4-[(E)-4-(2-methoxyphenyl)but-1-en-3-ynyl]phenyl]ethanone
CID 45102914
4-(2-methoxyphenyl)-N-methylbut-3-yn-1-amine
CID 170463916
2-(2-methoxyphenyl)ethynyl-trimethylsilane
CID 5140915
1-(3-bromoprop-1-ynyl)-2-methoxybenzene
CID 19973041
2-(2-methoxyphenyl)ethynesulfonyl fluoride
CID 162408413
3-(2-methoxyphenyl)prop-2-ynyl benzoate
CID 162397532
1-[(4-chlorophenyl)methyl]-3-[3-(2-methoxyphenyl)prop-2-ynyl]urea
CID 90553175
1,3-bis(2-methoxyphenyl)propane-1,3-dione
CID 15664665
1-methoxy-2-[2-[4-[4-[2-(2-methoxyphenyl)ethynyl]phenyl]phenyl]ethynyl]benzene
CID 70271277
(Z)-but-2-ene;2-methoxy-N-methylbenzamide
CID 144547446

Frequently Asked Questions

What is the IUPAC name of 3-(2-methoxyphenyl)-N-methylprop-2-ynamide?
The IUPAC name of 3-(2-methoxyphenyl)-N-methylprop-2-ynamide (CID 154718529) is 3-(2-methoxyphenyl)-N-methylprop-2-ynamide.
What is the SMILES notation for 3-(2-methoxyphenyl)-N-methylprop-2-ynamide?
The canonical SMILES for 3-(2-methoxyphenyl)-N-methylprop-2-ynamide is CNC(=O)C#Cc1ccccc1OC.
What is the InChIKey of 3-(2-methoxyphenyl)-N-methylprop-2-ynamide?
The InChIKey is SAEXBMFLFKILTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11NO2/c1-12-11(13)8-7-9-5-3-4-6-10(9)14-2/h3-6H,1-2H3,(H,12,13).
What are the key properties of 3-(2-methoxyphenyl)-N-methylprop-2-ynamide?
3-(2-methoxyphenyl)-N-methylprop-2-ynamide has a molecular weight of 189.21 g/mol, XLogP of 0.79, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methoxyphenyl)-N-methylprop-2-ynamide is sourced from PubChem (CID 154718529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).