N-(4-methoxyphenoxy)formamide

C8H9NO3 — CID 174284253

IUPACN-(4-methoxyphenoxy)formamide
SMILESCOc1ccc(ONC=O)cc1
InChIInChI=1S/C8H9NO3/c1-11-7-2-4-8(5-3-7)12-9-6-10/h2-6H,1H3,(H,9,10)
InChIKeyWHLUPNXMVXDYFB-UHFFFAOYSA-N
MW167.16 g/mol
LogP0.74
Rot. Bonds4

About N-(4-methoxyphenoxy)formamide

N-(4-methoxyphenoxy)formamide (PubChem CID 174284253) has the molecular formula C8H9NO3 and a molecular weight of 167.16 g/mol. Its IUPAC name is N-(4-methoxyphenoxy)formamide.

Molecular Properties

Compound NameN-(4-methoxyphenoxy)formamide
PubChem CID174284253
Molecular FormulaC8H9NO3
Molecular Weight167.16 g/mol
Exact Mass167.06
IUPAC NameN-(4-methoxyphenoxy)formamide
SMILESCOc1ccc(ONC=O)cc1
InChIInChI=1S/C8H9NO3/c1-11-7-2-4-8(5-3-7)12-9-6-10/h2-6H,1H3,(H,9,10)
InChIKeyWHLUPNXMVXDYFB-UHFFFAOYSA-N
XLogP0.74
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.16
LogP ≤ 50.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

4-methoxy(1,2,3,4,5,6-13C6)cyclohexa-1,3,5-triene-1-carbaldehyde
CID 46780459
N-formyl-4-methoxybenzamide
CID 10856056
N-[1-(4-methoxyphenyl)ethyl]formamide
CID 3115584
(4-methoxyphenoxy)carbamic acid
CID 152670091
N-[1-(4-methoxyphenyl)ethenyl]formamide
CID 14117206
N-[3-formamido-1,4-bis(4-methoxyphenyl)buta-1,3-dien-2-yl]formamide
CID 72970930
N-[4-(4-methoxyphenyl)anilino]formamide
CID 140931286
1-methoxy-4-(4-methoxyphenyl)selenonylbenzene
CID 11771710
N-(4-methoxyphenoxy)ethanamine
CID 88771391
formic acid;methyl 4-methoxybenzoate
CID 159779883
[4-(4-methoxyphenoxy)phenyl] formate
CID 88935611
(4-methoxyphenyl) 2-oxoacetate
CID 165359062

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenoxy)formamide?
The IUPAC name of N-(4-methoxyphenoxy)formamide (CID 174284253) is N-(4-methoxyphenoxy)formamide.
What is the SMILES notation for N-(4-methoxyphenoxy)formamide?
The canonical SMILES for N-(4-methoxyphenoxy)formamide is COc1ccc(ONC=O)cc1.
What is the InChIKey of N-(4-methoxyphenoxy)formamide?
The InChIKey is WHLUPNXMVXDYFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9NO3/c1-11-7-2-4-8(5-3-7)12-9-6-10/h2-6H,1H3,(H,9,10).
What are the key properties of N-(4-methoxyphenoxy)formamide?
N-(4-methoxyphenoxy)formamide has a molecular weight of 167.16 g/mol, XLogP of 0.74, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenoxy)formamide is sourced from PubChem (CID 174284253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).