N-methyl-N-(4-phenyl-2-pyridinyl)formamide

C13H12N2O — CID 145352685

IUPACN-methyl-N-(4-phenyl-2-pyridinyl)formamide
SMILESCN(C=O)c1cc(-c2ccccc2)ccn1
InChIInChI=1S/C13H12N2O/c1-15(10-16)13-9-12(7-8-14-13)11-5-3-2-4-6-11/h2-10H,1H3
InChIKeyLOICLZKXMDWBIC-UHFFFAOYSA-N
MW212.25 g/mol
LogP2.34
Rot. Bonds3

About N-methyl-N-(4-phenyl-2-pyridinyl)formamide

N-methyl-N-(4-phenyl-2-pyridinyl)formamide (PubChem CID 145352685) has the molecular formula C13H12N2O and a molecular weight of 212.25 g/mol. Its IUPAC name is N-methyl-N-(4-phenyl-2-pyridinyl)formamide.

Molecular Properties

Compound NameN-methyl-N-(4-phenyl-2-pyridinyl)formamide
PubChem CID145352685
Molecular FormulaC13H12N2O
Molecular Weight212.25 g/mol
Exact Mass212.09
IUPAC NameN-methyl-N-(4-phenyl-2-pyridinyl)formamide
SMILESCN(C=O)c1cc(-c2ccccc2)ccn1
InChIInChI=1S/C13H12N2O/c1-15(10-16)13-9-12(7-8-14-13)11-5-3-2-4-6-11/h2-10H,1H3
InChIKeyLOICLZKXMDWBIC-UHFFFAOYSA-N
XLogP2.34
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.25
LogP ≤ 52.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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-methyl-N-(4-phenyl-2-pyridinyl)formamide?
The IUPAC name of N-methyl-N-(4-phenyl-2-pyridinyl)formamide (CID 145352685) is N-methyl-N-(4-phenyl-2-pyridinyl)formamide.
What is the SMILES notation for N-methyl-N-(4-phenyl-2-pyridinyl)formamide?
The canonical SMILES for N-methyl-N-(4-phenyl-2-pyridinyl)formamide is CN(C=O)c1cc(-c2ccccc2)ccn1.
What is the InChIKey of N-methyl-N-(4-phenyl-2-pyridinyl)formamide?
The InChIKey is LOICLZKXMDWBIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12N2O/c1-15(10-16)13-9-12(7-8-14-13)11-5-3-2-4-6-11/h2-10H,1H3.
What are the key properties of N-methyl-N-(4-phenyl-2-pyridinyl)formamide?
N-methyl-N-(4-phenyl-2-pyridinyl)formamide has a molecular weight of 212.25 g/mol, XLogP of 2.34, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(4-phenyl-2-pyridinyl)formamide is sourced from PubChem (CID 145352685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).