N-phenylformamide

C7H7NO — CID 7671

IUPACN-phenylformamide
SMILESO=CNc1ccccc1
InChIInChI=1S/C7H7NO/c9-6-8-7-4-2-1-3-5-7/h1-6H,(H,8,9)
InChIKeyDYDNPESBYVVLBO-UHFFFAOYSA-N
MW121.14 g/mol
LogP1.25
Rot. Bonds2

About N-phenylformamide

N-phenylformamide (PubChem CID 7671) has the molecular formula C7H7NO and a molecular weight of 121.14 g/mol. Its IUPAC name is N-phenylformamide.

Molecular Properties

Compound NameN-phenylformamide
PubChem CID7671
Molecular FormulaC7H7NO
Molecular Weight121.14 g/mol
Exact Mass121.05
IUPAC NameN-phenylformamide
SMILESO=CNc1ccccc1
InChIInChI=1S/C7H7NO/c9-6-8-7-4-2-1-3-5-7/h1-6H,(H,8,9)
InChIKeyDYDNPESBYVVLBO-UHFFFAOYSA-N
XLogP1.25
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500121.14
LogP ≤ 51.25
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

Acetanilide
CID 904
N-Methylaniline
CID 7515
N-Ethylaniline
CID 7670
N-Isopropylaniline
CID 13032
2-Methylacetanilide
CID 12107
Diphenylformamide
CID 69081
Phenylurea
CID 6145
N-Butylaniline
CID 14310
4-Fluorophenylurea
CID 12612
Urea, N-(1-methylethyl)-N'-phenyl-
CID 29852
1-Methyl-3-phenylurea
CID 13880
Formamide, N-(2-methylphenyl)-
CID 7202

Frequently Asked Questions

What is the IUPAC name of N-phenylformamide?
The IUPAC name of N-phenylformamide (CID 7671) is N-phenylformamide.
What is the SMILES notation for N-phenylformamide?
The canonical SMILES for N-phenylformamide is O=CNc1ccccc1.
What is the InChIKey of N-phenylformamide?
The InChIKey is DYDNPESBYVVLBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7NO/c9-6-8-7-4-2-1-3-5-7/h1-6H,(H,8,9).
What are the key properties of N-phenylformamide?
N-phenylformamide has a molecular weight of 121.14 g/mol, XLogP of 1.25, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-phenylformamide is sourced from PubChem (CID 7671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).