[5-(ethylamino)-2-(methylamino)phenyl] formate

C10H14N2O2 — CID 143766620

IUPAC[5-(ethylamino)-2-(methylamino)phenyl] formate
SMILESCCNc1ccc(NC)c(OC=O)c1
InChIInChI=1S/C10H14N2O2/c1-3-12-8-4-5-9(11-2)10(6-8)14-7-13/h4-7,11-12H,3H2,1-2H3
InChIKeyZMQHSANKCCMVHV-UHFFFAOYSA-N
MW194.23 g/mol
LogP1.70
Rot. Bonds5

About [5-(ethylamino)-2-(methylamino)phenyl] formate

[5-(ethylamino)-2-(methylamino)phenyl] formate (PubChem CID 143766620) has the molecular formula C10H14N2O2 and a molecular weight of 194.23 g/mol. Its IUPAC name is [5-(ethylamino)-2-(methylamino)phenyl] formate.

Molecular Properties

Compound Name[5-(ethylamino)-2-(methylamino)phenyl] formate
PubChem CID143766620
Molecular FormulaC10H14N2O2
Molecular Weight194.23 g/mol
Exact Mass194.11
IUPAC Name[5-(ethylamino)-2-(methylamino)phenyl] formate
SMILESCCNc1ccc(NC)c(OC=O)c1
InChIInChI=1S/C10H14N2O2/c1-3-12-8-4-5-9(11-2)10(6-8)14-7-13/h4-7,11-12H,3H2,1-2H3
InChIKeyZMQHSANKCCMVHV-UHFFFAOYSA-N
XLogP1.70
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 51.70
H-Bond Donors ≤ 52
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 [5-(ethylamino)-2-(methylamino)phenyl] formate?
The IUPAC name of [5-(ethylamino)-2-(methylamino)phenyl] formate (CID 143766620) is [5-(ethylamino)-2-(methylamino)phenyl] formate.
What is the SMILES notation for [5-(ethylamino)-2-(methylamino)phenyl] formate?
The canonical SMILES for [5-(ethylamino)-2-(methylamino)phenyl] formate is CCNc1ccc(NC)c(OC=O)c1.
What is the InChIKey of [5-(ethylamino)-2-(methylamino)phenyl] formate?
The InChIKey is ZMQHSANKCCMVHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O2/c1-3-12-8-4-5-9(11-2)10(6-8)14-7-13/h4-7,11-12H,3H2,1-2H3.
What are the key properties of [5-(ethylamino)-2-(methylamino)phenyl] formate?
[5-(ethylamino)-2-(methylamino)phenyl] formate has a molecular weight of 194.23 g/mol, XLogP of 1.70, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(ethylamino)-2-(methylamino)phenyl] formate is sourced from PubChem (CID 143766620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).