N-(3-chloro-5-fluoro-4-methoxyphenyl)formamide

C8H7ClFNO2 — CID 168654188

IUPACN-(3-chloro-5-fluoro-4-methoxyphenyl)formamide
SMILESCOc1c(F)cc(NC=O)cc1Cl
InChIInChI=1S/C8H7ClFNO2/c1-13-8-6(9)2-5(11-4-12)3-7(8)10/h2-4H,1H3,(H,11,12)
InChIKeyDXPVFFBVEIFIAH-UHFFFAOYSA-N
MW203.60 g/mol
LogP2.06
Rot. Bonds3

About N-(3-chloro-5-fluoro-4-methoxyphenyl)formamide

N-(3-chloro-5-fluoro-4-methoxyphenyl)formamide (PubChem CID 168654188) has the molecular formula C8H7ClFNO2 and a molecular weight of 203.60 g/mol. Its IUPAC name is N-(3-chloro-5-fluoro-4-methoxyphenyl)formamide.

Molecular Properties

Compound NameN-(3-chloro-5-fluoro-4-methoxyphenyl)formamide
PubChem CID168654188
Molecular FormulaC8H7ClFNO2
Molecular Weight203.60 g/mol
Exact Mass203.01
IUPAC NameN-(3-chloro-5-fluoro-4-methoxyphenyl)formamide
SMILESCOc1c(F)cc(NC=O)cc1Cl
InChIInChI=1S/C8H7ClFNO2/c1-13-8-6(9)2-5(11-4-12)3-7(8)10/h2-4H,1H3,(H,11,12)
InChIKeyDXPVFFBVEIFIAH-UHFFFAOYSA-N
XLogP2.06
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.60
LogP ≤ 52.06
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

methyl 3-fluoro-5-formamido-4-methoxybenzoate
CID 168652166
N-(3,5-diformamidophenyl)formamide
CID 87263269
5-chloro-3-fluoro-2,4-dimethoxybenzaldehyde
CID 84684172
[(3-chloro-5-fluoro-4-methoxyphenyl)methylideneamino]urea
CID 168532968
2-(3-chloro-5-fluoro-4-methoxyphenyl)propanenitrile
CID 130135021
5-[(3-chloro-4-ethoxy-5-fluoroanilino)methylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione
CID 168540964
N-(3-fluoro-5-formyl-4-methoxyphenyl)acetamide
CID 84781458
5-chloro-3-fluoro-2-hydroxy-4-methoxybenzaldehyde
CID 84778086
(5-chloro-3-fluoro-2-methoxyphenyl)hydrazine
CID 90034743
1-(3-chloro-5-fluoro-4-methoxyphenyl)propan-2-amine
CID 117310361
N-[3,5-bis(methylamino)phenyl]formamide
CID 158907123
N-[(3,5-dichloro-4-methoxyphenyl)carbamoyl]-2,6-difluorobenzamide
CID 54288472

Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-5-fluoro-4-methoxyphenyl)formamide?
The IUPAC name of N-(3-chloro-5-fluoro-4-methoxyphenyl)formamide (CID 168654188) is N-(3-chloro-5-fluoro-4-methoxyphenyl)formamide.
What is the SMILES notation for N-(3-chloro-5-fluoro-4-methoxyphenyl)formamide?
The canonical SMILES for N-(3-chloro-5-fluoro-4-methoxyphenyl)formamide is COc1c(F)cc(NC=O)cc1Cl.
What is the InChIKey of N-(3-chloro-5-fluoro-4-methoxyphenyl)formamide?
The InChIKey is DXPVFFBVEIFIAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7ClFNO2/c1-13-8-6(9)2-5(11-4-12)3-7(8)10/h2-4H,1H3,(H,11,12).
What are the key properties of N-(3-chloro-5-fluoro-4-methoxyphenyl)formamide?
N-(3-chloro-5-fluoro-4-methoxyphenyl)formamide has a molecular weight of 203.60 g/mol, XLogP of 2.06, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-5-fluoro-4-methoxyphenyl)formamide is sourced from PubChem (CID 168654188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).