2-methoxy-4-[(4-methylanilino)methyl]phenol

C15H17NO2 — CID 4093534

IUPAC2-methoxy-4-[(4-methylanilino)methyl]phenol
SMILESCOc1cc(CNc2ccc(C)cc2)ccc1O
InChIInChI=1S/C15H17NO2/c1-11-3-6-13(7-4-11)16-10-12-5-8-14(17)15(9-12)18-2/h3-9,16-17H,10H2,1-2H3
InChIKeyDUDODTYBAZRSSV-UHFFFAOYSA-N
MW243.31 g/mol
LogP3.32
Rot. Bonds4

About 2-methoxy-4-[(4-methylanilino)methyl]phenol

2-methoxy-4-[(4-methylanilino)methyl]phenol (PubChem CID 4093534) has the molecular formula C15H17NO2 and a molecular weight of 243.31 g/mol. Its IUPAC name is 2-methoxy-4-[(4-methylanilino)methyl]phenol.

Molecular Properties

Compound Name2-methoxy-4-[(4-methylanilino)methyl]phenol
PubChem CID4093534
Molecular FormulaC15H17NO2
Molecular Weight243.31 g/mol
Exact Mass243.13
IUPAC Name2-methoxy-4-[(4-methylanilino)methyl]phenol
SMILESCOc1cc(CNc2ccc(C)cc2)ccc1O
InChIInChI=1S/C15H17NO2/c1-11-3-6-13(7-4-11)16-10-12-5-8-14(17)15(9-12)18-2/h3-9,16-17H,10H2,1-2H3
InChIKeyDUDODTYBAZRSSV-UHFFFAOYSA-N
XLogP3.32
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 53.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-[(3-hydroxy-4-methoxyanilino)methyl]-2-methoxyphenol
CID 43743646
4-[[4-(dimethylamino)anilino]methyl]-2-methoxyphenol
CID 39371639
2-[(4-hydroxy-3-methoxyphenyl)methylamino]-4-methylphenol
CID 83320633
2-[4-[(4-hydroxy-3-methoxyphenyl)methylamino]phenyl]acetonitrile
CID 43722167
4-[(3-bromo-4-methylanilino)methyl]-2-methoxyphenol
CID 63333437
2-methoxy-4-[(3,4,5-trifluoroanilino)methyl]phenol
CID 62809836
4-[(2-bromo-5-methylanilino)methyl]-2-methoxyphenol
CID 82762170
2-bromo-4-[(4-methylanilino)methyl]phenol
CID 55025634
4-[(3,5-dichloro-4-fluoroanilino)methyl]-2-methoxyphenol
CID 107572501
2-methoxy-4-[[[(1S)-1-(4-methylphenyl)ethyl]amino]methyl]phenol
CID 81348669
4-[[(5-fluoro-3-pyridinyl)amino]methyl]-2-methoxyphenol
CID 114254373
4-[(4-methoxy-3-methylphenyl)methylamino]phenol
CID 43790415

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-4-[(4-methylanilino)methyl]phenol?
The IUPAC name of 2-methoxy-4-[(4-methylanilino)methyl]phenol (CID 4093534) is 2-methoxy-4-[(4-methylanilino)methyl]phenol.
What is the SMILES notation for 2-methoxy-4-[(4-methylanilino)methyl]phenol?
The canonical SMILES for 2-methoxy-4-[(4-methylanilino)methyl]phenol is COc1cc(CNc2ccc(C)cc2)ccc1O.
What is the InChIKey of 2-methoxy-4-[(4-methylanilino)methyl]phenol?
The InChIKey is DUDODTYBAZRSSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO2/c1-11-3-6-13(7-4-11)16-10-12-5-8-14(17)15(9-12)18-2/h3-9,16-17H,10H2,1-2H3.
What are the key properties of 2-methoxy-4-[(4-methylanilino)methyl]phenol?
2-methoxy-4-[(4-methylanilino)methyl]phenol has a molecular weight of 243.31 g/mol, XLogP of 3.32, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-4-[(4-methylanilino)methyl]phenol is sourced from PubChem (CID 4093534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).