N-methyl-N-(2-phenoxyethyl)formamide

C10H13NO2 — CID 64992361

IUPACN-methyl-N-(2-phenoxyethyl)formamide
SMILESCN(C=O)CCOc1ccccc1
InChIInChI=1S/C10H13NO2/c1-11(9-12)7-8-13-10-5-3-2-4-6-10/h2-6,9H,7-8H2,1H3
InChIKeyCSPWUNRZWJYEOC-UHFFFAOYSA-N
MW179.22 g/mol
LogP1.15
Rot. Bonds5

About N-methyl-N-(2-phenoxyethyl)formamide

N-methyl-N-(2-phenoxyethyl)formamide (PubChem CID 64992361) has the molecular formula C10H13NO2 and a molecular weight of 179.22 g/mol. Its IUPAC name is N-methyl-N-(2-phenoxyethyl)formamide.

Molecular Properties

Compound NameN-methyl-N-(2-phenoxyethyl)formamide
PubChem CID64992361
Molecular FormulaC10H13NO2
Molecular Weight179.22 g/mol
Exact Mass179.09
IUPAC NameN-methyl-N-(2-phenoxyethyl)formamide
SMILESCN(C=O)CCOc1ccccc1
InChIInChI=1S/C10H13NO2/c1-11(9-12)7-8-13-10-5-3-2-4-6-10/h2-6,9H,7-8H2,1H3
InChIKeyCSPWUNRZWJYEOC-UHFFFAOYSA-N
XLogP1.15
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.22
LogP ≤ 51.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(2-phenoxyethyl)formamide?
The IUPAC name of N-methyl-N-(2-phenoxyethyl)formamide (CID 64992361) is N-methyl-N-(2-phenoxyethyl)formamide.
What is the SMILES notation for N-methyl-N-(2-phenoxyethyl)formamide?
The canonical SMILES for N-methyl-N-(2-phenoxyethyl)formamide is CN(C=O)CCOc1ccccc1.
What is the InChIKey of N-methyl-N-(2-phenoxyethyl)formamide?
The InChIKey is CSPWUNRZWJYEOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO2/c1-11(9-12)7-8-13-10-5-3-2-4-6-10/h2-6,9H,7-8H2,1H3.
What are the key properties of N-methyl-N-(2-phenoxyethyl)formamide?
N-methyl-N-(2-phenoxyethyl)formamide has a molecular weight of 179.22 g/mol, XLogP of 1.15, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(2-phenoxyethyl)formamide is sourced from PubChem (CID 64992361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).