N-(3-methoxyphenyl)-2-methylaniline

C14H15NO — CID 791041

IUPACN-(3-methoxyphenyl)-2-methylaniline
SMILESCOc1cccc(Nc2ccccc2C)c1
InChIInChI=1S/C14H15NO/c1-11-6-3-4-9-14(11)15-12-7-5-8-13(10-12)16-2/h3-10,15H,1-2H3
InChIKeyJPNDEZIQZCCRSO-UHFFFAOYSA-N
MW213.28 g/mol
LogP3.75
Rot. Bonds3

About N-(3-methoxyphenyl)-2-methylaniline

N-(3-methoxyphenyl)-2-methylaniline (PubChem CID 791041) has the molecular formula C14H15NO and a molecular weight of 213.28 g/mol. Its IUPAC name is N-(3-methoxyphenyl)-2-methylaniline.

Molecular Properties

Compound NameN-(3-methoxyphenyl)-2-methylaniline
PubChem CID791041
Molecular FormulaC14H15NO
Molecular Weight213.28 g/mol
Exact Mass213.12
IUPAC NameN-(3-methoxyphenyl)-2-methylaniline
SMILESCOc1cccc(Nc2ccccc2C)c1
InChIInChI=1S/C14H15NO/c1-11-6-3-4-9-14(11)15-12-7-5-8-13(10-12)16-2/h3-10,15H,1-2H3
InChIKeyJPNDEZIQZCCRSO-UHFFFAOYSA-N
XLogP3.75
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 53.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(3-methoxyphenyl)-2-methylaniline?
The IUPAC name of N-(3-methoxyphenyl)-2-methylaniline (CID 791041) is N-(3-methoxyphenyl)-2-methylaniline.
What is the SMILES notation for N-(3-methoxyphenyl)-2-methylaniline?
The canonical SMILES for N-(3-methoxyphenyl)-2-methylaniline is COc1cccc(Nc2ccccc2C)c1.
What is the InChIKey of N-(3-methoxyphenyl)-2-methylaniline?
The InChIKey is JPNDEZIQZCCRSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO/c1-11-6-3-4-9-14(11)15-12-7-5-8-13(10-12)16-2/h3-10,15H,1-2H3.
What are the key properties of N-(3-methoxyphenyl)-2-methylaniline?
N-(3-methoxyphenyl)-2-methylaniline has a molecular weight of 213.28 g/mol, XLogP of 3.75, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxyphenyl)-2-methylaniline is sourced from PubChem (CID 791041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).