3-[(2-methylphenyl)methylamino]phenol

C14H15NO — CID 28722272

IUPAC3-[(2-methylphenyl)methylamino]phenol
SMILESCc1ccccc1CNc1cccc(O)c1
InChIInChI=1S/C14H15NO/c1-11-5-2-3-6-12(11)10-15-13-7-4-8-14(16)9-13/h2-9,15-16H,10H2,1H3
InChIKeyDALXRIQRBLYKIS-UHFFFAOYSA-N
MW213.28 g/mol
LogP3.31
Rot. Bonds3

About 3-[(2-methylphenyl)methylamino]phenol

3-[(2-methylphenyl)methylamino]phenol (PubChem CID 28722272) has the molecular formula C14H15NO and a molecular weight of 213.28 g/mol. Its IUPAC name is 3-[(2-methylphenyl)methylamino]phenol.

Molecular Properties

Compound Name3-[(2-methylphenyl)methylamino]phenol
PubChem CID28722272
Molecular FormulaC14H15NO
Molecular Weight213.28 g/mol
Exact Mass213.12
IUPAC Name3-[(2-methylphenyl)methylamino]phenol
SMILESCc1ccccc1CNc1cccc(O)c1
InChIInChI=1S/C14H15NO/c1-11-5-2-3-6-12(11)10-15-13-7-4-8-14(16)9-13/h2-9,15-16H,10H2,1H3
InChIKeyDALXRIQRBLYKIS-UHFFFAOYSA-N
XLogP3.31
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 53.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-chloro-N-[(2-methylphenyl)methyl]aniline
CID 28513469
3-[(2-methyl-3-pyridinyl)methylamino]phenol
CID 99790074
1-N,4-N-bis[(2-methylphenyl)methyl]benzene-1,4-diamine
CID 102345817
N-[2-[(3-hydroxyanilino)methyl]phenyl]acetamide
CID 66385038
3-[(2,4,6-trimethylphenyl)methylamino]phenol
CID 28722294
N-[3-[(2-methylphenyl)methylamino]phenyl]propanamide
CID 28661897
N-methyl-3-[(2-methylphenyl)methylamino]benzamide
CID 28650229
3-[(2,3-difluorophenyl)methylamino]phenol
CID 63667379
N-[(2-methylphenyl)methyl]-3-phenylmethoxyaniline
CID 54801284
2-[(2,6-dimethylanilino)methyl]phenol
CID 4863460
3-(ethylamino)phenol
CID 578991
4-[3-[(2-methylphenyl)methylamino]phenoxy]butanenitrile
CID 60943112

Frequently Asked Questions

What is the IUPAC name of 3-[(2-methylphenyl)methylamino]phenol?
The IUPAC name of 3-[(2-methylphenyl)methylamino]phenol (CID 28722272) is 3-[(2-methylphenyl)methylamino]phenol.
What is the SMILES notation for 3-[(2-methylphenyl)methylamino]phenol?
The canonical SMILES for 3-[(2-methylphenyl)methylamino]phenol is Cc1ccccc1CNc1cccc(O)c1.
What is the InChIKey of 3-[(2-methylphenyl)methylamino]phenol?
The InChIKey is DALXRIQRBLYKIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO/c1-11-5-2-3-6-12(11)10-15-13-7-4-8-14(16)9-13/h2-9,15-16H,10H2,1H3.
What are the key properties of 3-[(2-methylphenyl)methylamino]phenol?
3-[(2-methylphenyl)methylamino]phenol has a molecular weight of 213.28 g/mol, XLogP of 3.31, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-methylphenyl)methylamino]phenol is sourced from PubChem (CID 28722272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).