N-methyl-N-phenylaniline

C13H13N — CID 11098

IUPACN-methyl-N-phenylaniline
SMILESCN(c1ccccc1)c1ccccc1
InChIInChI=1S/C13H13N/c1-14(12-8-4-2-5-9-12)13-10-6-3-7-11-13/h2-11H,1H3
InChIKeyDYFFAVRFJWYYQO-UHFFFAOYSA-N
MW183.25 g/mol
LogP3.45
Rot. Bonds2

About N-methyl-N-phenylaniline

N-methyl-N-phenylaniline (PubChem CID 11098) has the molecular formula C13H13N and a molecular weight of 183.25 g/mol. Its IUPAC name is N-methyl-N-phenylaniline.

Molecular Properties

Compound NameN-methyl-N-phenylaniline
PubChem CID11098
Molecular FormulaC13H13N
Molecular Weight183.25 g/mol
Exact Mass183.10
IUPAC NameN-methyl-N-phenylaniline
SMILESCN(c1ccccc1)c1ccccc1
InChIInChI=1S/C13H13N/c1-14(12-8-4-2-5-9-12)13-10-6-3-7-11-13/h2-11H,1H3
InChIKeyDYFFAVRFJWYYQO-UHFFFAOYSA-N
XLogP3.45
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.25
LogP ≤ 53.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-phenylaniline?
The IUPAC name of N-methyl-N-phenylaniline (CID 11098) is N-methyl-N-phenylaniline.
What is the SMILES notation for N-methyl-N-phenylaniline?
The canonical SMILES for N-methyl-N-phenylaniline is CN(c1ccccc1)c1ccccc1.
What is the InChIKey of N-methyl-N-phenylaniline?
The InChIKey is DYFFAVRFJWYYQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N/c1-14(12-8-4-2-5-9-12)13-10-6-3-7-11-13/h2-11H,1H3.
What are the key properties of N-methyl-N-phenylaniline?
N-methyl-N-phenylaniline has a molecular weight of 183.25 g/mol, XLogP of 3.45, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-phenylaniline is sourced from PubChem (CID 11098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).