N-methyl-2-(3-methylphenyl)aniline

C14H15N — CID 59454343

IUPACN-methyl-2-(3-methylphenyl)aniline
SMILESCNc1ccccc1-c1cccc(C)c1
InChIInChI=1S/C14H15N/c1-11-6-5-7-12(10-11)13-8-3-4-9-14(13)15-2/h3-10,15H,1-2H3
InChIKeyOVSDMPPMSHFTNK-UHFFFAOYSA-N
MW197.28 g/mol
LogP3.70
Rot. Bonds2

About N-methyl-2-(3-methylphenyl)aniline

N-methyl-2-(3-methylphenyl)aniline (PubChem CID 59454343) has the molecular formula C14H15N and a molecular weight of 197.28 g/mol. Its IUPAC name is N-methyl-2-(3-methylphenyl)aniline.

Molecular Properties

Compound NameN-methyl-2-(3-methylphenyl)aniline
PubChem CID59454343
Molecular FormulaC14H15N
Molecular Weight197.28 g/mol
Exact Mass197.12
IUPAC NameN-methyl-2-(3-methylphenyl)aniline
SMILESCNc1ccccc1-c1cccc(C)c1
InChIInChI=1S/C14H15N/c1-11-6-5-7-12(10-11)13-8-3-4-9-14(13)15-2/h3-10,15H,1-2H3
InChIKeyOVSDMPPMSHFTNK-UHFFFAOYSA-N
XLogP3.70
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(3-methylphenyl)aniline?
The IUPAC name of N-methyl-2-(3-methylphenyl)aniline (CID 59454343) is N-methyl-2-(3-methylphenyl)aniline.
What is the SMILES notation for N-methyl-2-(3-methylphenyl)aniline?
The canonical SMILES for N-methyl-2-(3-methylphenyl)aniline is CNc1ccccc1-c1cccc(C)c1.
What is the InChIKey of N-methyl-2-(3-methylphenyl)aniline?
The InChIKey is OVSDMPPMSHFTNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N/c1-11-6-5-7-12(10-11)13-8-3-4-9-14(13)15-2/h3-10,15H,1-2H3.
What are the key properties of N-methyl-2-(3-methylphenyl)aniline?
N-methyl-2-(3-methylphenyl)aniline has a molecular weight of 197.28 g/mol, XLogP of 3.70, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(3-methylphenyl)aniline is sourced from PubChem (CID 59454343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).