N-phenyl-N-(pyridin-2-ylmethyl)formamide

C13H12N2O — CID 59806637

IUPACN-phenyl-N-(pyridin-2-ylmethyl)formamide
SMILESO=CN(Cc1ccccn1)c1ccccc1
InChIInChI=1S/C13H12N2O/c16-11-15(13-7-2-1-3-8-13)10-12-6-4-5-9-14-12/h1-9,11H,10H2
InChIKeyCGRFCXKHZRKIAP-UHFFFAOYSA-N
MW212.25 g/mol
LogP2.24
Rot. Bonds4

About N-phenyl-N-(pyridin-2-ylmethyl)formamide

N-phenyl-N-(pyridin-2-ylmethyl)formamide (PubChem CID 59806637) has the molecular formula C13H12N2O and a molecular weight of 212.25 g/mol. Its IUPAC name is N-phenyl-N-(pyridin-2-ylmethyl)formamide.

Molecular Properties

Compound NameN-phenyl-N-(pyridin-2-ylmethyl)formamide
PubChem CID59806637
Molecular FormulaC13H12N2O
Molecular Weight212.25 g/mol
Exact Mass212.09
IUPAC NameN-phenyl-N-(pyridin-2-ylmethyl)formamide
SMILESO=CN(Cc1ccccn1)c1ccccc1
InChIInChI=1S/C13H12N2O/c16-11-15(13-7-2-1-3-8-13)10-12-6-4-5-9-14-12/h1-9,11H,10H2
InChIKeyCGRFCXKHZRKIAP-UHFFFAOYSA-N
XLogP2.24
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.25
LogP ≤ 52.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-phenyl-N-(pyridin-2-ylmethyl)formamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-phenyl-N-(pyridin-2-ylmethyl)pyrimidin-2-amine
CID 141149663
(E)-N,N,N',N'-tetrakis(pyridin-2-ylmethyl)ethene-1,2-diamine
CID 22115004
N-phenyl-N-(pyridin-2-ylmethyl)benzamide
CID 12559708
copper;1-pyridin-2-yl-N,N-bis(pyridin-2-ylmethyl)methanamine
CID 130339696
1-[2-[[bis(pyridin-2-ylmethyl)amino]methyl]phenyl]-N,N-bis(pyridin-2-ylmethyl)methanamine
CID 54154120
CID 88902013
CID 88902013
N-(naphthalen-1-ylmethyl)-N-(pyridin-2-ylmethyl)formamide
CID 169111587
N-methyl-1-pyridin-2-yl-N-(pyridin-2-ylmethyl)methanamine;hydrochloride
CID 174963433
ethane;N-methyl-1-pyridin-2-yl-N-(pyridin-2-ylmethyl)methanamine
CID 145471467
2-amino-N-phenyl-N-(pyridin-2-ylmethyl)propanamide
CID 68993512
6-[ethyl(pyridin-2-ylmethyl)amino]pyridine-3-carbaldehyde
CID 80632829
osmium;pyridine-2-carboxylic acid;1-pyridin-2-yl-N,N-bis(pyridin-2-ylmethyl)methanamine
CID 171575278

Frequently Asked Questions

What is the IUPAC name of N-phenyl-N-(pyridin-2-ylmethyl)formamide?
The IUPAC name of N-phenyl-N-(pyridin-2-ylmethyl)formamide (CID 59806637) is N-phenyl-N-(pyridin-2-ylmethyl)formamide.
What is the SMILES notation for N-phenyl-N-(pyridin-2-ylmethyl)formamide?
The canonical SMILES for N-phenyl-N-(pyridin-2-ylmethyl)formamide is O=CN(Cc1ccccn1)c1ccccc1.
What is the InChIKey of N-phenyl-N-(pyridin-2-ylmethyl)formamide?
The InChIKey is CGRFCXKHZRKIAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12N2O/c16-11-15(13-7-2-1-3-8-13)10-12-6-4-5-9-14-12/h1-9,11H,10H2.
What are the key properties of N-phenyl-N-(pyridin-2-ylmethyl)formamide?
N-phenyl-N-(pyridin-2-ylmethyl)formamide has a molecular weight of 212.25 g/mol, XLogP of 2.24, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-phenyl-N-(pyridin-2-ylmethyl)formamide is sourced from PubChem (CID 59806637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).