N-(2-methylphenyl)-N-phenylethanimidamide

C15H16N2 — CID 118689628

IUPACN-(2-methylphenyl)-N-phenylethanimidamide
SMILES[H]/N=C(\C)N(c1ccccc1)c1ccccc1C
InChIInChI=1S/C15H16N2/c1-12-8-6-7-11-15(12)17(13(2)16)14-9-4-3-5-10-14/h3-11,16H,1-2H3/b16-13+
InChIKeyOIBDUGNNCRKKTH-DTQAZKPQSA-N
MW224.31 g/mol
LogP4.13
Rot. Bonds2

About N-(2-methylphenyl)-N-phenylethanimidamide

N-(2-methylphenyl)-N-phenylethanimidamide (PubChem CID 118689628) has the molecular formula C15H16N2 and a molecular weight of 224.31 g/mol. Its IUPAC name is N-(2-methylphenyl)-N-phenylethanimidamide.

Molecular Properties

Compound NameN-(2-methylphenyl)-N-phenylethanimidamide
PubChem CID118689628
Molecular FormulaC15H16N2
Molecular Weight224.31 g/mol
Exact Mass224.13
IUPAC NameN-(2-methylphenyl)-N-phenylethanimidamide
SMILES[H]/N=C(\C)N(c1ccccc1)c1ccccc1C
InChIInChI=1S/C15H16N2/c1-12-8-6-7-11-15(12)17(13(2)16)14-9-4-3-5-10-14/h3-11,16H,1-2H3/b16-13+
InChIKeyOIBDUGNNCRKKTH-DTQAZKPQSA-N
XLogP4.13
TPSA27.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.31
LogP ≤ 54.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(2-methylphenyl)-N-phenylethanimidamide?
The IUPAC name of N-(2-methylphenyl)-N-phenylethanimidamide (CID 118689628) is N-(2-methylphenyl)-N-phenylethanimidamide.
What is the SMILES notation for N-(2-methylphenyl)-N-phenylethanimidamide?
The canonical SMILES for N-(2-methylphenyl)-N-phenylethanimidamide is [H]/N=C(\C)N(c1ccccc1)c1ccccc1C.
What is the InChIKey of N-(2-methylphenyl)-N-phenylethanimidamide?
The InChIKey is OIBDUGNNCRKKTH-DTQAZKPQSA-N. The full InChI is InChI=1S/C15H16N2/c1-12-8-6-7-11-15(12)17(13(2)16)14-9-4-3-5-10-14/h3-11,16H,1-2H3/b16-13+.
What are the key properties of N-(2-methylphenyl)-N-phenylethanimidamide?
N-(2-methylphenyl)-N-phenylethanimidamide has a molecular weight of 224.31 g/mol, XLogP of 4.13, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylphenyl)-N-phenylethanimidamide is sourced from PubChem (CID 118689628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).