[2-[formyl(methyl)amino]-6-methoxyphenyl] formate

C10H11NO4 — CID 174808992

IUPAC[2-[formyl(methyl)amino]-6-methoxyphenyl] formate
SMILESCOc1cccc(N(C)C=O)c1OC=O
InChIInChI=1S/C10H11NO4/c1-11(6-12)8-4-3-5-9(14-2)10(8)15-7-13/h3-7H,1-2H3
InChIKeyCUHUVWMEYUUBPK-UHFFFAOYSA-N
MW209.20 g/mol
LogP0.82
Rot. Bonds5

About [2-[formyl(methyl)amino]-6-methoxyphenyl] formate

[2-[formyl(methyl)amino]-6-methoxyphenyl] formate (PubChem CID 174808992) has the molecular formula C10H11NO4 and a molecular weight of 209.20 g/mol. Its IUPAC name is [2-[formyl(methyl)amino]-6-methoxyphenyl] formate.

Molecular Properties

Compound Name[2-[formyl(methyl)amino]-6-methoxyphenyl] formate
PubChem CID174808992
Molecular FormulaC10H11NO4
Molecular Weight209.20 g/mol
Exact Mass209.07
IUPAC Name[2-[formyl(methyl)amino]-6-methoxyphenyl] formate
SMILESCOc1cccc(N(C)C=O)c1OC=O
InChIInChI=1S/C10H11NO4/c1-11(6-12)8-4-3-5-9(14-2)10(8)15-7-13/h3-7H,1-2H3
InChIKeyCUHUVWMEYUUBPK-UHFFFAOYSA-N
XLogP0.82
TPSA55.84 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.20
LogP ≤ 50.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [2-[formyl(methyl)amino]-6-methoxyphenyl] formate?
The IUPAC name of [2-[formyl(methyl)amino]-6-methoxyphenyl] formate (CID 174808992) is [2-[formyl(methyl)amino]-6-methoxyphenyl] formate.
What is the SMILES notation for [2-[formyl(methyl)amino]-6-methoxyphenyl] formate?
The canonical SMILES for [2-[formyl(methyl)amino]-6-methoxyphenyl] formate is COc1cccc(N(C)C=O)c1OC=O.
What is the InChIKey of [2-[formyl(methyl)amino]-6-methoxyphenyl] formate?
The InChIKey is CUHUVWMEYUUBPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11NO4/c1-11(6-12)8-4-3-5-9(14-2)10(8)15-7-13/h3-7H,1-2H3.
What are the key properties of [2-[formyl(methyl)amino]-6-methoxyphenyl] formate?
[2-[formyl(methyl)amino]-6-methoxyphenyl] formate has a molecular weight of 209.20 g/mol, XLogP of 0.82, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[formyl(methyl)amino]-6-methoxyphenyl] formate is sourced from PubChem (CID 174808992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).