N-(2-methoxyphenyl)-N-methylformamide

C9H11NO2 — CID 12838509

IUPACN-(2-methoxyphenyl)-N-methylformamide
SMILESCOc1ccccc1N(C)C=O
InChIInChI=1S/C9H11NO2/c1-10(7-11)8-5-3-4-6-9(8)12-2/h3-7H,1-2H3
InChIKeyXXCFUYBMLLEKMY-UHFFFAOYSA-N
MW165.19 g/mol
LogP1.29
Rot. Bonds3

About N-(2-methoxyphenyl)-N-methylformamide

N-(2-methoxyphenyl)-N-methylformamide (PubChem CID 12838509) has the molecular formula C9H11NO2 and a molecular weight of 165.19 g/mol. Its IUPAC name is N-(2-methoxyphenyl)-N-methylformamide.

Molecular Properties

Compound NameN-(2-methoxyphenyl)-N-methylformamide
PubChem CID12838509
Molecular FormulaC9H11NO2
Molecular Weight165.19 g/mol
Exact Mass165.08
IUPAC NameN-(2-methoxyphenyl)-N-methylformamide
SMILESCOc1ccccc1N(C)C=O
InChIInChI=1S/C9H11NO2/c1-10(7-11)8-5-3-4-6-9(8)12-2/h3-7H,1-2H3
InChIKeyXXCFUYBMLLEKMY-UHFFFAOYSA-N
XLogP1.29
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.19
LogP ≤ 51.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

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CID 23198488
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Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyphenyl)-N-methylformamide?
The IUPAC name of N-(2-methoxyphenyl)-N-methylformamide (CID 12838509) is N-(2-methoxyphenyl)-N-methylformamide.
What is the SMILES notation for N-(2-methoxyphenyl)-N-methylformamide?
The canonical SMILES for N-(2-methoxyphenyl)-N-methylformamide is COc1ccccc1N(C)C=O.
What is the InChIKey of N-(2-methoxyphenyl)-N-methylformamide?
The InChIKey is XXCFUYBMLLEKMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11NO2/c1-10(7-11)8-5-3-4-6-9(8)12-2/h3-7H,1-2H3.
What are the key properties of N-(2-methoxyphenyl)-N-methylformamide?
N-(2-methoxyphenyl)-N-methylformamide has a molecular weight of 165.19 g/mol, XLogP of 1.29, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyphenyl)-N-methylformamide is sourced from PubChem (CID 12838509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).