N-(4-chlorophenyl)formamide

C7H6ClNO — CID 17475

IUPACN-(4-chlorophenyl)formamide
SMILESO=CNc1ccc(Cl)cc1
InChIInChI=1S/C7H6ClNO/c8-6-1-3-7(4-2-6)9-5-10/h1-5H,(H,9,10)
InChIKeyLMLFHXMNNHGRRO-UHFFFAOYSA-N
MW155.58 g/mol
LogP1.91
Rot. Bonds2

About N-(4-chlorophenyl)formamide

N-(4-chlorophenyl)formamide (PubChem CID 17475) has the molecular formula C7H6ClNO and a molecular weight of 155.58 g/mol. Its IUPAC name is N-(4-chlorophenyl)formamide.

Molecular Properties

Compound NameN-(4-chlorophenyl)formamide
PubChem CID17475
Molecular FormulaC7H6ClNO
Molecular Weight155.58 g/mol
Exact Mass155.01
IUPAC NameN-(4-chlorophenyl)formamide
SMILESO=CNc1ccc(Cl)cc1
InChIInChI=1S/C7H6ClNO/c8-6-1-3-7(4-2-6)9-5-10/h1-5H,(H,9,10)
InChIKeyLMLFHXMNNHGRRO-UHFFFAOYSA-N
XLogP1.91
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.58
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

Monuron
CID 8800
Formanilide
CID 7671
Monolinuron
CID 15629
4-Chlorophenylurea
CID 8796
Monomethylmonuron
CID 79309
N-(4-Chlorophenyl)acetamide
CID 10871
4-Chloro-N-methylbenzenamine
CID 70272
2,4'-Dichloroacetanilide
CID 94920
Carbamic acid, N-(4-chlorophenyl)-, ethyl ester
CID 17496
Acetamide, N-(4-chlorophenyl)-2-cyano-
CID 87269
1-(4-Chlorophenyl)-3-cyclohexylurea
CID 238899
Formamide, N-(2-chlorophenyl)-
CID 137653

Frequently Asked Questions

What is the IUPAC name of N-(4-chlorophenyl)formamide?
The IUPAC name of N-(4-chlorophenyl)formamide (CID 17475) is N-(4-chlorophenyl)formamide.
What is the SMILES notation for N-(4-chlorophenyl)formamide?
The canonical SMILES for N-(4-chlorophenyl)formamide is O=CNc1ccc(Cl)cc1.
What is the InChIKey of N-(4-chlorophenyl)formamide?
The InChIKey is LMLFHXMNNHGRRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6ClNO/c8-6-1-3-7(4-2-6)9-5-10/h1-5H,(H,9,10).
What are the key properties of N-(4-chlorophenyl)formamide?
N-(4-chlorophenyl)formamide has a molecular weight of 155.58 g/mol, XLogP of 1.91, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chlorophenyl)formamide is sourced from PubChem (CID 17475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).