N-(4-methylphenyl)-N-phenylformamide

C14H13NO — CID 11063734

IUPACN-(4-methylphenyl)-N-phenylformamide
SMILESCc1ccc(N(C=O)c2ccccc2)cc1
InChIInChI=1S/C14H13NO/c1-12-7-9-14(10-8-12)15(11-16)13-5-3-2-4-6-13/h2-11H,1H3
InChIKeyUTQYESDLIRZKGE-UHFFFAOYSA-N
MW211.26 g/mol
LogP3.29
Rot. Bonds3

About N-(4-methylphenyl)-N-phenylformamide

N-(4-methylphenyl)-N-phenylformamide (PubChem CID 11063734) has the molecular formula C14H13NO and a molecular weight of 211.26 g/mol. Its IUPAC name is N-(4-methylphenyl)-N-phenylformamide.

Molecular Properties

Compound NameN-(4-methylphenyl)-N-phenylformamide
PubChem CID11063734
Molecular FormulaC14H13NO
Molecular Weight211.26 g/mol
Exact Mass211.10
IUPAC NameN-(4-methylphenyl)-N-phenylformamide
SMILESCc1ccc(N(C=O)c2ccccc2)cc1
InChIInChI=1S/C14H13NO/c1-12-7-9-14(10-8-12)15(11-16)13-5-3-2-4-6-13/h2-11H,1H3
InChIKeyUTQYESDLIRZKGE-UHFFFAOYSA-N
XLogP3.29
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.26
LogP ≤ 53.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(4-methylphenyl)-N-phenylformamide?
The IUPAC name of N-(4-methylphenyl)-N-phenylformamide (CID 11063734) is N-(4-methylphenyl)-N-phenylformamide.
What is the SMILES notation for N-(4-methylphenyl)-N-phenylformamide?
The canonical SMILES for N-(4-methylphenyl)-N-phenylformamide is Cc1ccc(N(C=O)c2ccccc2)cc1.
What is the InChIKey of N-(4-methylphenyl)-N-phenylformamide?
The InChIKey is UTQYESDLIRZKGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13NO/c1-12-7-9-14(10-8-12)15(11-16)13-5-3-2-4-6-13/h2-11H,1H3.
What are the key properties of N-(4-methylphenyl)-N-phenylformamide?
N-(4-methylphenyl)-N-phenylformamide has a molecular weight of 211.26 g/mol, XLogP of 3.29, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methylphenyl)-N-phenylformamide is sourced from PubChem (CID 11063734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).