4-methoxy-3-methyl-N-phenylaniline

C14H15NO — CID 23635969

IUPAC4-methoxy-3-methyl-N-phenylaniline
SMILESCOc1ccc(Nc2ccccc2)cc1C
InChIInChI=1S/C14H15NO/c1-11-10-13(8-9-14(11)16-2)15-12-6-4-3-5-7-12/h3-10,15H,1-2H3
InChIKeyNTDVKARQFOALDU-UHFFFAOYSA-N
MW213.28 g/mol
LogP3.75
Rot. Bonds3

About 4-methoxy-3-methyl-N-phenylaniline

4-methoxy-3-methyl-N-phenylaniline (PubChem CID 23635969) has the molecular formula C14H15NO and a molecular weight of 213.28 g/mol. Its IUPAC name is 4-methoxy-3-methyl-N-phenylaniline.

Molecular Properties

Compound Name4-methoxy-3-methyl-N-phenylaniline
PubChem CID23635969
Molecular FormulaC14H15NO
Molecular Weight213.28 g/mol
Exact Mass213.12
IUPAC Name4-methoxy-3-methyl-N-phenylaniline
SMILESCOc1ccc(Nc2ccccc2)cc1C
InChIInChI=1S/C14H15NO/c1-11-10-13(8-9-14(11)16-2)15-12-6-4-3-5-7-12/h3-10,15H,1-2H3
InChIKeyNTDVKARQFOALDU-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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Related Compounds

4-N-(3,4-dimethylphenyl)-1-N-phenylbenzene-1,4-diamine
CID 139604467
(4-anilino-2-methylphenyl) 2-methylprop-2-enoate
CID 21326582
ethane;4-methoxy-N,3-dimethylaniline
CID 142876075
N-(4-methoxy-3-methylphenyl)-4,6-dimethyl-1,3,5-triazin-2-amine
CID 163936403
1-N-iodo-2-methoxy-4-N-phenylbenzene-1,4-diamine
CID 154558823
3-methoxy-4-methyl-N-phenylaniline;oxido sulfite
CID 91481114
N-(4-methoxy-3-methylphenyl)quinolin-4-amine
CID 142581718
3-N-(4-methoxy-3-methylphenyl)-4-methylbenzene-1,3-diamine
CID 55091364
4-anilino-2-methoxybenzenediazonium bromide
CID 19770680
3-methoxy-4-methyl-N-phenylaniline;4-methylbenzenesulfonic acid
CID 91301925
N-(4-methoxy-3-methylphenyl)-1-phenylmethanesulfonamide
CID 110776446
3-chloro-2-N-(4-methoxy-3-methylphenyl)benzene-1,2-diamine
CID 54964711

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-3-methyl-N-phenylaniline?
The IUPAC name of 4-methoxy-3-methyl-N-phenylaniline (CID 23635969) is 4-methoxy-3-methyl-N-phenylaniline.
What is the SMILES notation for 4-methoxy-3-methyl-N-phenylaniline?
The canonical SMILES for 4-methoxy-3-methyl-N-phenylaniline is COc1ccc(Nc2ccccc2)cc1C.
What is the InChIKey of 4-methoxy-3-methyl-N-phenylaniline?
The InChIKey is NTDVKARQFOALDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO/c1-11-10-13(8-9-14(11)16-2)15-12-6-4-3-5-7-12/h3-10,15H,1-2H3.
What are the key properties of 4-methoxy-3-methyl-N-phenylaniline?
4-methoxy-3-methyl-N-phenylaniline 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 4-methoxy-3-methyl-N-phenylaniline is sourced from PubChem (CID 23635969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).