N-(2-ethoxy-3-fluorophenyl)formamide

C9H10FNO2 — CID 168653296

IUPACN-(2-ethoxy-3-fluorophenyl)formamide
SMILESCCOc1c(F)cccc1NC=O
InChIInChI=1S/C9H10FNO2/c1-2-13-9-7(10)4-3-5-8(9)11-6-12/h3-6H,2H2,1H3,(H,11,12)
InChIKeyFPNDEIKYIIZFCP-UHFFFAOYSA-N
MW183.18 g/mol
LogP1.79
Rot. Bonds4

About N-(2-ethoxy-3-fluorophenyl)formamide

N-(2-ethoxy-3-fluorophenyl)formamide (PubChem CID 168653296) has the molecular formula C9H10FNO2 and a molecular weight of 183.18 g/mol. Its IUPAC name is N-(2-ethoxy-3-fluorophenyl)formamide.

Molecular Properties

Compound NameN-(2-ethoxy-3-fluorophenyl)formamide
PubChem CID168653296
Molecular FormulaC9H10FNO2
Molecular Weight183.18 g/mol
Exact Mass183.07
IUPAC NameN-(2-ethoxy-3-fluorophenyl)formamide
SMILESCCOc1c(F)cccc1NC=O
InChIInChI=1S/C9H10FNO2/c1-2-13-9-7(10)4-3-5-8(9)11-6-12/h3-6H,2H2,1H3,(H,11,12)
InChIKeyFPNDEIKYIIZFCP-UHFFFAOYSA-N
XLogP1.79
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.18
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(2-ethoxy-3-fluorophenyl)thiourea
CID 169358055
N-(3-fluoro-2-methylphenyl)formamide
CID 45090567
2-ethoxy-3-fluorobenzonitrile
CID 90422615
N-(2,4-dichloro-3-ethoxyphenyl)formamide
CID 118874942
2-[[3-fluoro-2-(2-methylpropoxy)anilino]methylidene]propanedinitrile
CID 168543446
2-ethoxy-3-fluorobenzenesulfonic acid;hydrochloride
CID 174857894
1-N,3-N-bis(2-ethoxy-3-fluorophenyl)-4-methoxybenzene-1,3-disulfonamide
CID 141157222
2-ethoxy-N-[2-(ethylamino)ethyl]-3-fluorobenzamide;hydrochloride
CID 119505079
2-ethoxybenzene-1,3-dicarbaldehyde
CID 15757941
N-(3-ethoxyphenyl)formamide
CID 57236062
5-[(3-chloro-2-ethoxyanilino)methylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione
CID 168537516
1-(2,6-difluorophenyl)-3-(2-ethoxyphenyl)urea
CID 108992038

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxy-3-fluorophenyl)formamide?
The IUPAC name of N-(2-ethoxy-3-fluorophenyl)formamide (CID 168653296) is N-(2-ethoxy-3-fluorophenyl)formamide.
What is the SMILES notation for N-(2-ethoxy-3-fluorophenyl)formamide?
The canonical SMILES for N-(2-ethoxy-3-fluorophenyl)formamide is CCOc1c(F)cccc1NC=O.
What is the InChIKey of N-(2-ethoxy-3-fluorophenyl)formamide?
The InChIKey is FPNDEIKYIIZFCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10FNO2/c1-2-13-9-7(10)4-3-5-8(9)11-6-12/h3-6H,2H2,1H3,(H,11,12).
What are the key properties of N-(2-ethoxy-3-fluorophenyl)formamide?
N-(2-ethoxy-3-fluorophenyl)formamide has a molecular weight of 183.18 g/mol, XLogP of 1.79, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxy-3-fluorophenyl)formamide is sourced from PubChem (CID 168653296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).